SMILES
stringlengths 6
120
| Deep SMILES
stringlengths 6
124
| SELFIES
stringlengths 18
409
| SAFE
stringlengths 9
126
|
|---|---|---|---|
CCSc1cncc(C(=O)N[C@H]2C=CCN(C(=O)Cn3nccc3C)C2)n1
|
CCSccnccC=O)N[C@H]C=CCNC=O)Cnnccc5C))))))))C6))))))))n6
|
[C][C][S][C][=C][N][=C][C][Branch2][Ring1][=N][C][=Branch1][C][=O][N][C@H1][C][=C][C][N][Branch1][=C][C][=Branch1][C][=O][C][N][N][=C][C][=C][Ring1][Branch1][C][C][Ring1][#C][=N][Ring2][Ring1][Branch2]
|
c1%10cncc8n1.C17C=CCN5C1.n19nccc1C.C5(=O)C9.C48=O.CC6.S6%10.N47
|
COCc1ccc(C(=O)NCC(C)(C)NC(=O)c2cnn3ccccc23)cc1F
|
COCccccC=O)NCCC)C)NC=O)ccnnccccc96)))))))))))))))cc6F
|
[C][O][C][C][=C][C][=C][Branch2][Ring1][S][C][=Branch1][C][=O][N][C][C][Branch1][C][C][Branch1][C][C][N][C][=Branch1][C][=O][C][C][=N][N][C][=C][C][=C][C][=Ring1][=Branch2][Ring1][=Branch1][C][=C][Ring2][Ring1][=Branch2][F]
|
c1%10cnn2ccccc12.c1%11ccc9cc1F.C7C8(C)C.C49=O.C5%10=O.CO6.C6%11.N47.N58
|
CCCc1ccc(C(=O)N2CCOC[C@@H](NC(=O)c3cnc4ccsc4c3)C2)s1
|
CCCccccC=O)NCCOC[C@@H]NC=O)ccncccsc5c9)))))))))))C7))))))))s5
|
[C][C][C][C][=C][C][=C][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][C][C][O][C][C@@H1][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C][=C][N][=C][C][=C][S][C][Ring1][Branch1][=C][Ring1][=Branch2][C][Ring2][Ring1][Ring1][S][Ring2][Ring1][#Branch2]
|
c19cnc2ccsc2c1.N15CCOCC7C1.c1%10ccc8s1.CCC%10.C58=O.C69=O.N67
|
CO[C@H](C(=O)N1CCN(C(=O)C(C)(C)c2cncnc2)C[C@H]1CCO)C(C)(C)C
|
CO[C@H]C=O)NCCNC=O)CC)C)ccncnc6))))))))C[C@H]6CCO))))))))))CC)C)C
|
[C][O][C@H1][Branch2][Ring2][=Branch1][C][=Branch1][C][=O][N][C][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C][=C][N][=C][N][=C][Ring1][=Branch1][C][C@H1][Ring1][P][C][C][O][C][Branch1][C][C][Branch1][C][C][C]
|
C5(C3=O)C(C)(C)C.N13CCN4CC16.C4(=O)C7(C)C.c17cncnc1.C6CO.CO5
|
O=C(C[C@@H]1CSc2ccccc2O1)N1CC(c2ccnc(-c3ncccn3)n2)C1
|
O=CC[C@@H]CScccccc6O%10)))))))))))NCCcccnc-cncccn6))))))n6))))))C4
|
[O][=C][Branch1][S][C][C@@H1][C][S][C][=C][C][=C][C][=C][Ring1][=Branch1][O][Ring1][#Branch2][N][C][C][Branch2][Ring1][Ring1][C][=C][C][=N][C][Branch1][=Branch2][C][=N][C][=C][C][=N][Ring1][=Branch1][=N][Ring1][N][C][Ring1][S]
|
C15CSc2ccccc2O1.c17ccnc6n1.c16ncccn1.N14CC7C1.O=C4C5
|
CSCCNC(=O)[C@H](CCc1c(Cl)cccc1Cl)N1CC[C@@H](C)[C@@H](C)C1
|
CSCCNC=O)[C@H]CCccCl)cccc6Cl)))))))))NCC[C@@H]C)[C@@H]C)C6
|
[C][S][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][#C][C][C][C][=C][Branch1][C][Cl][C][=C][C][=C][Ring1][#Branch1][Cl][N][C][C][C@@H1][Branch1][C][C][C@@H1][Branch1][C][C][C][Ring1][Branch2]
|
c16c(Cl)cccc1Cl.N14CCC(C)C(C)C1.C2(=O)C4CC6.C5C3.CS5.N23
|
Cc1c(C(=O)NC[C@@H]2CCN(C(=O)CCP(C)(C)=O)CC2(F)F)ccn1CCO
|
CccC=O)NC[C@@H]CCNC=O)CCPC)C)=O)))))CC6F)F))))))))))ccn5CCO
|
[C][C][=C][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C][C@@H1][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][C][P][Branch1][C][C][Branch1][C][C][=O][C][C][Ring1][=C][Branch1][C][F][F][C][=C][N][Ring2][Ring1][=Branch2][C][C][O]
|
C18CCN4CC1(F)F.C4(=O)CCP(C)(C)=O.Cc1c6ccn17.C36=O.C7CO.N35.C58
|
C[C@@H](Nc1ncc(S(=O)(=O)NC2CC(C#N)C2)cc1Cl)c1csnn1
|
C[C@@H]NcnccS=O)=O)NCCCC#N))C4))))))cc6Cl))))))))ccsnn5
|
[C][C@@H1][Branch2][Ring1][S][N][C][=N][C][=C][Branch2][Ring1][Ring1][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][C][Branch1][Ring1][C][#N][C][Ring1][=Branch1][C][=C][Ring1][S][Cl][C][=C][S][N][=N][Ring1][Branch1]
|
c15ncc(S4(=O)=O)cc1Cl.C16CC(C#N)C1.c17csnn1.CC37.N35.N46
|
O=C(NC[C@@H]1CCN(C(=O)[C@H]2C=CCCC2)C12CC2)c1ncc(Cl)cc1F
|
O=CNC[C@@H]CCNC=O)[C@H]C=CCCC6)))))))C5CC3)))))))))cnccCl)cc6F
|
[O][=C][Branch2][Ring1][N][N][C][C@@H1][C][C][N][Branch1][=N][C][=Branch1][C][=O][C@H1][C][=C][C][C][C][Ring1][=Branch1][C][Ring1][=N][C][C][Ring1][Ring1][C][=N][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][F]
|
C18CCN4C12CC2.c16ncc(Cl)cc1F.C17C=CCCC1.O=C36.C47=O.N35.C58
|
O=C(N[C@@]12C[C@@H]1CN(C(=O)c1csc(-c3ccoc3)n1)C2)[C@@H]1CCC[C@H]1C1CC1
|
O=CN[C@@]C[C@@H]3CNC=O)ccsc-cccoc5)))))n5))))))C6)))))))[C@@H]CCC[C@H]5CCC3
|
[O][=C][Branch2][Ring2][Ring2][N][C@@][C][C@@H1][Ring1][Ring1][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C][=C][S][C][Branch1][Branch2][C][C][=C][O][C][=Ring1][Branch1][=N][Ring1][#Branch2][C][Ring2][Ring1][C][C@@H1][C][C][C][C@H1][Ring1][Branch1][C][C][C][Ring1][Ring1]
|
C18CCCC1C1CC1.C126CC1CN5C2.c17csc9n1.c19ccoc1.O=C48.C57=O.N46
|
COCCO[C@H](C)C(=O)N(C)CC[C@@H](NC(=O)CC1=CCCCC1)C(C)C
|
COCCO[C@H]C)C=O)NC)CC[C@@H]NC=O)CC=CCCCC6)))))))))CC)C
|
[C][O][C][C][O][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C][C@@H1][Branch1][#C][N][C][=Branch1][C][=O][C][C][=C][C][C][C][C][Ring1][=Branch1][C][Branch1][C][C][C]
|
C3(=O)CC1=CCCCC1.C7CC8C(C)C.C6(C)C2=O.C4C5.N27C.CO4.O56.N38
|
CC(C)C[C@@H](CNC(=O)c1c(F)ccc(C#N)c1F)NC(=O)c1cccnc1S
|
CCC)C[C@@H]CNC=O)ccF)cccC#N))c6F))))))))))NC=O)ccccnc6S
|
[C][C][Branch1][C][C][C][C@@H1][Branch2][Ring1][#Branch1][C][N][C][=Branch1][C][=O][C][=C][Branch1][C][F][C][=C][C][Branch1][Ring1][C][#N][=C][Ring1][=Branch2][F][N][C][=Branch1][C][=O][C][=C][C][=C][N][=C][Ring1][=Branch1][S]
|
c16c(F)ccc(C#N)c1F.CC(C)CC4C5.c17cccnc1S.C26=O.C37=O.N25.N34
|
C=CC1(CC(=O)N2CCN(C(=O)c3cnn(C(C)C)n3)[C@H](CO)C2)CC1
|
C=CCCC=O)NCCNC=O)ccnnCC)C))n5))))))[C@H]CO))C6))))))))CC3
|
[C][=C][C][Branch2][Ring2][Branch2][C][C][=Branch1][C][=O][N][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][C][=N][N][Branch1][=Branch1][C][Branch1][C][C][C][N][=Ring1][Branch2][C@H1][Branch1][Ring1][C][O][C][Ring2][Ring1][C][C][C][Ring2][Ring1][Branch2]
|
N14CCN5C8C1.c16cnn7n1.C=CC19CC1.C9C4=O.C56=O.C7(C)C.C8O
|
CC[C@@H](CO)C(=O)N1C[C@]2(C)CN(C(=O)[C@H]3CCn4cc(C)nc4C3)C[C@]2(C)C1
|
CC[C@@H]CO))C=O)NC[C@]C)CNC=O)[C@H]CCnccC)nc5C9))))))))))C[C@]5C)C8
|
[C][C][C@@H1][Branch1][Ring1][C][O][C][=Branch1][C][=O][N][C][C@][Branch1][C][C][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C@H1][C][C][N][C][=C][Branch1][C][C][N][=C][Ring1][=Branch1][C][Ring1][#Branch2][C][C@][Ring2][Ring1][C][Branch1][C][C][C][Ring2][Ring1][=Branch1]
|
N15CC2(C)CN6CC2(C)C1.C17CCn2cc(C)nc2C1.CCC(CO)C5=O.C67=O
|
CCN(C[C@H]1CCCN1C(=O)C[C@]1(C)CCCO1)C(=O)C#CC1CCOCC1
|
CCNC[C@H]CCCN5C=O)C[C@]C)CCCO5)))))))))))))C=O)C#CCCCOCC6
|
[C][C][N][Branch2][Ring1][Branch2][C][C@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C@][Branch1][C][C][C][C][C][O][Ring1][=Branch1][C][=Branch1][C][=O][C][#C][C][C][C][O][C][C][Ring1][=Branch1]
|
C3(=O)C#CC1CCOCC1.C16CCCN12.C17(C)CCCO1.C2(=O)C7.N345.CC4.C56
|
CCN(CC1CCN(C(=O)C(C)(C)[C@H]2CCCO2)CC1)C(=O)c1coc(CO)c1
|
CCNCCCCNC=O)CC)C)[C@H]CCCO5)))))))CC6)))))))C=O)ccocCO))c5
|
[C][C][N][Branch2][Ring1][#C][C][C][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C@H1][C][C][C][O][Ring1][Branch1][C][C][Ring1][S][C][=Branch1][C][=O][C][=C][O][C][Branch1][Ring1][C][O][=C][Ring1][#Branch1]
|
C1%10CCN3CC1.C3(=O)C8(C)C.c17coc9c1.C18CCCO1.N456.C47=O.CC5.C6%10.C9O
|
CCc1nccnc1C(=O)NC[C@@H]1CC[C@@H]2CN(C(=O)[C@H](O)CC(C)(C)C)C[C@@H]21
|
CCcnccnc6C=O)NC[C@@H]CC[C@@H]CNC=O)[C@H]O)CCC)C)C)))))C[C@@H]58
|
[C][C][C][=N][C][=C][N][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C@@H1][C][C][C@@H1][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C@H1][Branch1][C][O][C][C][Branch1][C][C][Branch1][C][C][C][C][C@@H1][Ring1][=C][Ring1][P]
|
C18CCC2CN4CC12.C4(=O)C(O)CC(C)(C)C.c17nccnc16.C36=O.CC7.N35.C58
|
C=CCCCc1cn([C@H]2CC[C@@H](N(C)C(=O)CSc3c(C)n[nH]c3C)CC2)nn1
|
C=CCCCccn[C@H]CC[C@@H]NC)C=O)CSccC)n[nH]c5C))))))))))CC6))))))nn5
|
[C][=C][C][C][C][C][=C][N][Branch2][Ring2][C][C@H1][C][C][C@@H1][Branch2][Ring1][=Branch1][N][Branch1][C][C][C][=Branch1][C][=O][C][S][C][C][Branch1][C][C][=N][NH1][C][=Ring1][=Branch1][C][C][C][Ring2][Ring1][Ring1][N][=N][Ring2][Ring1][Branch2]
|
C18CCC6CC1.c19c(C)n[nH]c1C.c17cn8nn1.C=CCCC7.C4(=O)C5.N46C.S59
|
CCSC[C@H](CO)NC(=O)CC(C)(C)CNC(=O)C(C)=C1CCCC1
|
CCSC[C@H]CO))NC=O)CCC)C)CNC=O)CC)=CCCCC5
|
[C][C][S][C][C@H1][Branch1][Ring1][C][O][N][C][=Branch1][C][=O][C][C][Branch1][C][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C][Branch1][C][C][=C][C][C][C][C][Ring1][Branch1]
|
C2(=O)CC(C)(C)C5.C7C4CO.C3(=O)C=8C.C1=8CCCC1.CC6.S67.N24.N35
|
CC(C)N1CCO[C@H](C(=O)N[C@H](C)C2CCN(C(=O)CCSCC(N)=O)CC2)C1
|
CCC)NCCO[C@H]C=O)N[C@H]C)CCCNC=O)CCSCCN)=O)))))))CC6)))))))))C6
|
[C][C][Branch1][C][C][N][C][C][O][C@H1][Branch2][Ring1][P][C][=Branch1][C][=O][N][C@H1][Branch1][C][C][C][C][C][N][Branch1][=C][C][=Branch1][C][=O][C][C][S][C][C][Branch1][C][N][=O][C][C][Ring1][#C][C][Ring2][Ring1][#Branch2]
|
N15CCOC9C1.C1%10CCN4CC1.C4(=O)CC7.C8C(N)=O.CC5C.C39=O.C6%10C.N36.S78
|
CN1CCC[C@@H](C(=O)NCC(C)(C)NC(=O)c2cc(Cc3ccccc3)c[nH]2)C1
|
CNCCC[C@@H]C=O)NCCC)C)NC=O)cccCcccccc6)))))))c[nH]5)))))))))))C6
|
[C][N][C][C][C][C@@H1][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C][C][Branch1][C][C][Branch1][C][C][N][C][=Branch1][C][=O][C][=C][C][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][NH1][Ring1][N][C][Ring2][Ring1][N]
|
CN1CCCC9C1.c18cc%10c[nH]1.c1%11ccccc1.C6C7(C)C.C49=O.C58=O.N46.N57.C%10%11
|
CCc1noc(C)c1CNC(=O)C[C@H]1CN(C(=O)c2cc(Cl)n(C)n2)CC12CC2
|
CCcnocC)c5CNC=O)C[C@H]CNC=O)cccCl)nC)n5))))))CC5CC3
|
[C][C][C][=N][O][C][Branch1][C][C][=C][Ring1][=Branch1][C][N][C][=Branch1][C][=O][C][C@H1][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][C][=C][Branch1][C][Cl][N][Branch1][C][C][N][=Ring1][#Branch1][C][C][Ring1][=C][C][C][Ring1][Ring1]
|
C18CN4CC12CC2.c17noc(C)c19.c16cc(Cl)n(C)n1.C3(=O)C8.C46=O.CC7.C59.N35
|
COC[C@@H](NC(=O)c1cnc(C(C)C)s1)c1ccccn1
|
COC[C@@H]NC=O)ccncCC)C))s5)))))))cccccn6
|
[C][O][C][C@@H1][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C][=C][N][=C][Branch1][=Branch1][C][Branch1][C][C][C][S][Ring1][Branch2][C][=C][C][=C][C][=N][Ring1][=Branch1]
|
c15cnc7s1.c16ccccn1.C3C46.C25=O.C7(C)C.CO3.N24
|
Cn1cccc(C(=O)NCc2n[nH]cc2C(=O)N2CCOC[C@H]2CCO)c1=O
|
CnccccC=O)NCcn[nH]cc5C=O)NCCOC[C@H]6CCO))))))))))))))))))c6=O
|
[C][N][C][=C][C][=C][Branch2][Ring1][=N][C][=Branch1][C][=O][N][C][C][=N][NH1][C][=C][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][O][C][C@H1][Ring1][=Branch1][C][C][O][C][Ring2][Ring1][#Branch2][=O]
|
Cn1cccc6c1=O.N14CCOCC18.c19n[nH]cc17.C36=O.C47=O.C8CO.N35.C59
|
CC(=O)Nc1cncc(-c2ccc(CNCc3cc(F)c(O)cc3F)nc2)c1
|
CC=O)Nccncc-ccccCNCcccF)cO)cc6F))))))))))nc6))))))c6
|
[C][C][=Branch1][C][=O][N][C][=C][N][=C][C][Branch2][Ring1][#C][C][=C][C][=C][Branch2][Ring1][Ring1][C][N][C][C][=C][C][Branch1][C][F][=C][Branch1][C][O][C][=C][Ring1][Branch2][F][N][=C][Ring2][Ring1][C][=C][Ring2][Ring1][Branch2]
|
c19cc(F)c(O)cc1F.c17cncc%10c1.c1%10ccc8nc1.CC4=O.N47.C58.N56.C69
|
N#Cc1cc(NC(=O)[C@@H](CC(F)F)c2ccc(F)cc2)ccc1Cl
|
N#CcccNC=O)[C@@H]CCF)F)))ccccF)cc6)))))))))ccc6Cl
|
[N][#C][C][=C][C][Branch2][Ring1][#Branch2][N][C][=Branch1][C][=O][C@@H1][Branch1][#Branch1][C][C][Branch1][C][F][F][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][=C][C][=C][Ring2][Ring1][Branch1][Cl]
|
N#Cc1cc4ccc1Cl.C3(=O)C5CC(F)F.c15ccc(F)cc1.N34
|
Cc1ccc(C(=O)NC[C@@H]2CCC(C)(C)O2)c(-n2cc([C@H](C)N(C)C)nn2)c1
|
CccccC=O)NC[C@@H]CCCC)C)O5))))))))c-ncc[C@H]C)NC)C)))nn5)))))c6
|
[C][C][=C][C][=C][Branch2][Ring1][Ring2][C][=Branch1][C][=O][N][C][C@@H1][C][C][C][Branch1][C][C][Branch1][C][C][O][Ring1][#Branch1][C][Branch2][Ring1][Ring1][N][C][=C][Branch1][#Branch2][C@H1][Branch1][C][C][N][Branch1][C][C][C][N][=N][Ring1][#Branch2][=C][Ring2][Ring1][O]
|
Cc1ccc6c9c1.C17CCC(C)(C)O1.n19cc8nn1.C36=O.C58C.N5(C)C.N34.C47
|
NC(=O)CSCC(=O)N[C@H](CC(=O)NCC1CCCCCC1)C1CC1
|
NC=O)CSCC=O)N[C@H]CC=O)NCCCCCCCC7)))))))))))CCC3
|
[N][C][=Branch1][C][=O][C][S][C][C][=Branch1][C][=O][N][C@H1][Branch1][P][C][C][=Branch1][C][=O][N][C][C][C][C][C][C][C][C][Ring1][#Branch1][C][C][C][Ring1][Ring1]
|
C19CCCCCC1.C48CC3=O.NC(=O)C6.C7C2=O.C18CC1.S67.N24.N35.C59
|
COCCNC(=O)C(=O)N1CCCN(C(=O)c2cccc(CSC)c2)C[C@H]1CO
|
COCCNC=O)C=O)NCCCNC=O)cccccCSC)))c6)))))))C[C@H]7CO
|
[C][O][C][C][N][C][=Branch1][C][=O][C][=Branch1][C][=O][N][C][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][Ring2][C][S][C][=C][Ring1][=Branch2][C][C@H1][Ring2][Ring1][C][C][O]
|
N14CCCN5CC1%10.c19cccc%11c1.C3(=O)C4=O.C6C7.C59=O.CO6.N37.C8%11.S8C.C%10O
|
CC(C)C1(CNC(=NCCN2CCOCC2)N[C@H]2C[C@H](OC(C)(C)C)C2)CC1
|
CCC)CCNC=NCCNCCOCC6)))))))))N[C@H]C[C@H]OCC)C)C)))C4))))))))CC3
|
[C][C][Branch1][C][C][C][Branch2][Ring2][Ring1][C][N][C][=Branch1][N][=N][C][C][N][C][C][O][C][C][Ring1][=Branch1][N][C@H1][C][C@H1][Branch1][#Branch2][O][C][Branch1][C][C][Branch1][C][C][C][C][Ring1][=Branch2][C][C][Ring2][Ring1][=Branch2]
|
N5C(=NCC6)N7.N16CCOCC1.C17CC4C1.C189CC1.C3(C)(C)C.CC8C.C59.O34
|
CCCN(CCNC(=O)[C@H]1C[C@]2(C)C[C@@H]1CO2)C(=O)CCn1ccnn1
|
CCCNCCNC=O)[C@H]C[C@]C)C[C@@H]5CO5)))))))))))C=O)CCnccnn5
|
[C][C][C][N][Branch2][Ring1][=Branch1][C][C][N][C][=Branch1][C][=O][C@H1][C][C@][Branch1][C][C][C][C@@H1][Ring1][=Branch1][C][O][Ring1][=Branch1][C][=Branch1][C][=O][C][C][N][C][=C][N][=N][Ring1][Branch1]
|
C18CC2(C)CC1CO2.C4(=O)CC9.n19ccnn1.CCC5.N456.C6C7.C38=O.N37
|
CO[C@H]1C[C@@H](O)CN(C(=O)CN2CCN(C(=O)c3cc(O)nc(C)n3)CC2)C1
|
CO[C@H]C[C@@H]O)CNC=O)CNCCNC=O)cccO)ncC)n6)))))))CC6))))))))C6
|
[C][O][C@H1][C][C@@H1][Branch1][C][O][C][N][Branch2][Ring2][Ring1][C][=Branch1][C][=O][C][N][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][=C][C][Branch1][C][O][=N][C][Branch1][C][C][=N][Ring1][Branch2][C][C][Ring1][S][C][Ring2][Ring1][#Branch2]
|
C16CC(O)CN4C1.c18cc(O)nc(C)n1.N17CCN5CC1.C4(=O)C7.C58=O.CO6
|
C[C@@H](CN(C)C(=O)[C@H]1CC(=O)CCO1)C(=O)NC12CC(C1)C2
|
C[C@@H]CNC)C=O)[C@H]CC=O)CCO6)))))))))C=O)NCCCC4)C4
|
[C][C@@H1][Branch2][Ring1][Branch1][C][N][Branch1][C][C][C][=Branch1][C][=O][C@H1][C][C][=Branch1][C][=O][C][C][O][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C][C][Branch1][Ring2][C][Ring1][Ring2][C][Ring1][Branch1]
|
C17CC(=O)CCO1.CC(C5)C4=O.C126CC(C1)C2.N35C.C37=O.N46
|
C[C@@]1(CC(=O)N2CC[C@@H](CC(F)F)C2)CCN1C(=O)c1cc[n+]([O-])cc1
|
C[C@@]CC=O)NCC[C@@H]CCF)F)))C5)))))))CCN4C=O)ccc[n+][O-])cc6
|
[C][C@@][Branch2][Ring1][Branch1][C][C][=Branch1][C][=O][N][C][C][C@@H1][Branch1][#Branch1][C][C][Branch1][C][F][F][C][Ring1][=Branch2][C][C][N][Ring1][S][C][=Branch1][C][=O][C][=C][C][=N+1][Branch1][C][O-1][C][=C][Ring1][#Branch1]
|
c15cc[n+]([O-])cc1.CC16CCN14.N13CCC7C1.C6C3=O.C7C(F)F.C45=O
|
CCC[C@@]1(NC(=O)c2cnc(CC3CC3)s2)CCCN(C(=O)CCSC)C1
|
CCC[C@@]NC=O)ccncCCCC3))))s5)))))))CCCNC=O)CCSC)))))C6
|
[C][C][C][C@@][Branch2][Ring1][Branch1][N][C][=Branch1][C][=O][C][=C][N][=C][Branch1][#Branch1][C][C][C][C][Ring1][Ring1][S][Ring1][=Branch2][C][C][C][N][Branch1][=Branch2][C][=Branch1][C][=O][C][C][S][C][C][Ring2][Ring1][Branch2]
|
C16%10CCCN5C1.c18cnc9s1.C5(=O)CC7.CCC%10.C48=O.C1%11CC1.N46.C9%11.S7C
|
COC(=O)N[C@@H](C)C(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1n[nH]c(C)n1
|
COC=O)N[C@@H]C)C=O)NC[C@@H]CC[C@H]C7)N5C=O)Ccn[nH]cC)n5
|
[C][O][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C@@H1][C][C][C@H1][Branch1][Ring2][C][Ring1][#Branch1][N][Ring1][=Branch1][C][=Branch1][C][=O][C][C][=N][NH1][C][Branch1][C][C][=N][Ring1][=Branch1]
|
N15CC2CCC(C1)N26.c18n[nH]c(C)n1.C7(C)C5=O.C6(=O)C8.C34=O.CO3.N47
|
CC(C)[C@@H](C(=O)N1[C@H]2CC[C@@H]1C[C@@H]2NC(=O)c1cncc(Cl)c1Cl)n1cccc1
|
CCC)[C@@H]C=O)N[C@H]CC[C@@H]5C[C@@H]6NC=O)ccnccCl)c6Cl)))))))))))))))))ncccc5
|
[C][C][Branch1][C][C][C@@H1][Branch2][Ring1][P][C][=Branch1][C][=O][N][C@H1][C][C][C@@H1][Ring1][Branch1][C][C@@H1][Ring1][=Branch1][N][C][=Branch1][C][=O][C][=C][N][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1][Cl][N][C][=C][C][=C][Ring1][Branch1]
|
N13C2CCC1C5C2.c16cncc(Cl)c1Cl.CC(C)C7C3=O.n17cccc1.C46=O.N45
|
CN(C(=O)c1nc(C(F)(F)F)cs1)[C@H]1CCN(C(=O)[C@]2(Cl)CC23CCC3)C1
|
CNC=O)cncCF)F)F))cs5))))))[C@H]CCNC=O)[C@]Cl)CC3CCC4)))))))C5
|
[C][N][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][C][=N][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][S][Ring1][=Branch2][C@H1][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C@][Branch1][C][Cl][C][C][Ring1][Ring2][C][C][C][Ring1][Ring2][C][Ring1][=C]
|
C18(Cl)CC12CCC2.c17nc9cs1.C16CCN5C1.C9(F)(F)F.CN46.C47=O.C58=O
|
C[C@]1(F)CC[C@@H](C(=O)N[C@@H]2CN(C(=O)C34CCC(CO)(CC3)CC4)[C@H]3C[C@@H]23)CC1
|
C[C@]F)CC[C@@H]C=O)N[C@@H]CNC=O)CCCCCO))CC6))CC6)))))))[C@H]C[C@@H]63))))))))CC6
|
[C][C@][Branch1][C][F][C][C][C@@H1][Branch2][Ring2][#Branch2][C][=Branch1][C][=O][N][C@@H1][C][N][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][C][C][C][C][Branch1][Ring1][C][O][Branch1][Branch1][C][C][Ring1][Branch2][C][C][Ring1][#Branch2][C@H1][C][C@@H1][Ring2][Ring1][C][Ring1][Ring1][C][C][Ring2][Ring1][N]
|
C129CCC%10(CC1)CC2.CC1(F)CCC8CC1.C17CN6C2CC12.C58=O.C69=O.N57.C%10O
|
C[C@@H](NC(=O)c1nn(C)c(Cl)c1Cl)[C@@H](CO)NC(=O)c1cccc([N+](=O)[O-])c1N
|
C[C@@H]NC=O)cnnC)cCl)c5Cl))))))))[C@@H]CO))NC=O)ccccc[N+]=O)[O-]))c6N
|
[C][C@@H1][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C][=N][N][Branch1][C][C][C][Branch1][C][Cl][=C][Ring1][#Branch1][Cl][C@@H1][Branch1][Ring1][C][O][N][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][=C][Ring1][=Branch2][N]
|
c17cccc([N+](=O)[O-])c1N.c16nn(C)c(Cl)c1Cl.CC4C5CO.C26=O.C37=O.N24.N35
|
C=C1CC(C(=O)N[C@@H](C(=O)N2C[C@@H](O)C[C@H]2CO)c2ccccc2)C1
|
C=CCCC=O)N[C@@H]C=O)NC[C@@H]O)C[C@H]5CO))))))))cccccc6)))))))))C4
|
[C][=C][C][C][Branch2][Ring1][P][C][=Branch1][C][=O][N][C@@H1][Branch1][P][C][=Branch1][C][=O][N][C][C@@H1][Branch1][C][O][C][C@H1][Ring1][=Branch1][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring2][Ring1][Branch2]
|
N14CC(O)CC17.c18ccccc1.C=C1CC6C1.C58C4=O.C36=O.N35.C7O
|
Cc1cccc(C(=O)NCC(=O)NC[C@H]2CN(C(=O)c3cc(C)on3)CCO2)c1
|
CcccccC=O)NCC=O)NC[C@H]CNC=O)cccC)on5))))))CCO6))))))))))))c6
|
[C][C][=C][C][=C][C][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C][C][=Branch1][C][=O][N][C][C@H1][C][N][Branch1][#C][C][=Branch1][C][=O][C][C][=C][Branch1][C][C][O][N][=Ring1][=Branch1][C][C][O][Ring1][=C][=C][Ring2][Ring1][N]
|
Cc1cccc%10c1.C1%11CN6CCO1.c19cc(C)on1.C7C5=O.C4%10=O.C69=O.N47.N58.C8%11
|
O=C(NCc1ccc(SCCO)cc1)c1nccn2c(Br)cnc12
|
O=CNCccccSCCO))))cc6))))))))cnccncBr)cnc95
|
[O][=C][Branch1][P][N][C][C][=C][C][=C][Branch1][Branch1][S][C][C][O][C][=C][Ring1][#Branch2][C][=N][C][=C][N][C][Branch1][C][Br][=C][N][=C][Ring1][#Branch2][Ring1][=Branch1]
|
c16nccn2c(Br)cnc12.c17ccc8cc1.O=C36.C5CO.N34.C47.S58
|
CSc1nc(C(=O)NCC(=O)N2CCN(C(=O)[C@H]3C[C@H]3F)CC2)cs1
|
CScncC=O)NCC=O)NCCNC=O)[C@H]C[C@H]3F)))))CC6))))))))))cs5
|
[C][S][C][=N][C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C][C][=Branch1][C][=O][N][C][C][N][Branch1][O][C][=Branch1][C][=O][C@H1][C][C@H1][Ring1][Ring1][F][C][C][Ring1][N][=C][S][Ring2][Ring1][#Branch1]
|
N15CCN6CC1.c1%10nc8cs1.C7C5=O.C19CC1F.C48=O.C69=O.CS%10.N47
|
COC[C@@H](O)CCNC(=O)[C@@H](NC(=O)[C@H](C)N=[N+]=[N-])C1CCCCC1
|
COC[C@@H]O)CCNC=O)[C@@H]NC=O)[C@H]C)N=[N+]=[N-]))))))CCCCCC6
|
[C][O][C][C@@H1][Branch1][C][O][C][C][N][C][=Branch1][C][=O][C@@H1][Branch1][=N][N][C][=Branch1][C][=O][C@H1][Branch1][C][C][N][=N+1][=N-1][C][C][C][C][C][C][Ring1][=Branch1]
|
C3(=O)C(C)N=[N+]=[N-].C4C(O)CC5.C17CCCCC1.C2(=O)C67.CO4.N25.N36
|
CCN(C(=O)[C@H](C)NC(N)=O)[C@H]1CCCN(C(=O)C2(OC)CCCC2)CC1
|
CCNC=O)[C@H]C)NCN)=O)))))[C@H]CCCNC=O)COC))CCCC5))))))CC7
|
[C][C][N][Branch1][#C][C][=Branch1][C][=O][C@H1][Branch1][C][C][N][C][Branch1][C][N][=O][C@H1][C][C][C][N][Branch1][S][C][=Branch1][C][=O][C][Branch1][Ring1][O][C][C][C][C][C][Ring1][#Branch1][C][C][Ring1][S]
|
C19CCCN5CC1.C16%10CCCC1.C3(=O)C8C.N379.C4(N)=O.C5%10=O.CC7.N48.O6C
|
C[C@H](CCNC(=O)c1ccc(Cl)c(F)c1)N(C)C(=O)[C@@H](C)C(F)(F)C(F)F
|
C[C@H]CCNC=O)ccccCl)cF)c6))))))))))NC)C=O)[C@@H]C)CF)F)CF)F
|
[C][C@H1][Branch2][Ring1][=Branch1][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][Cl][C][Branch1][C][F][=C][Ring1][Branch2][N][Branch1][C][C][C][=Branch1][C][=O][C@@H1][Branch1][C][C][C][Branch1][C][F][Branch1][C][F][C][Branch1][C][F][F]
|
C3(=O)C(C)C(F)(F)C(F)F.c16ccc(Cl)c(F)c1.CC4CC5.C26=O.N34C.N25
|
COC1(C(=O)N[C@H]2CC[C@H](NC(=O)[C@@H](CO)C(F)(F)F)C2)CCC(C)CC1
|
COCC=O)N[C@H]CC[C@H]NC=O)[C@@H]CO))CF)F)F)))))C5)))))))CCCC)CC6
|
[C][O][C][Branch2][Ring2][C][C][=Branch1][C][=O][N][C@H1][C][C][C@H1][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C@@H1][Branch1][Ring1][C][O][C][Branch1][C][F][Branch1][C][F][F][C][Ring1][#C][C][C][C][Branch1][C][C][C][C][Ring2][Ring1][=Branch2]
|
C4(=O)C(CO)C(F)(F)F.C158CCC(C)CC1.C16CCC7C1.C38=O.CO5.N36.N47
|
Cc1nc(-c2ncccn2)sc1C(=O)N[C@@H]1CC[C@H](CCNC(=O)C=C2CC2)C1
|
Ccnc-cncccn6))))))sc5C=O)N[C@@H]CC[C@H]CCNC=O)C=CCC3))))))))C5
|
[C][C][N][=C][Branch1][=Branch2][C][=N][C][=C][C][=N][Ring1][=Branch1][S][C][=Ring1][O][C][=Branch1][C][=O][N][C@@H1][C][C][C@H1][Branch1][=C][C][C][N][C][=Branch1][C][=O][C][=C][C][C][Ring1][Ring1][C][Ring1][=C]
|
Cc1nc%10sc17.c1%10ncccn1.C16CCC9C1.C4(=O)C=8.C37=O.C9C5.C1=8CC1.N36.N45
|
C=C=C[C@H](C)C(=O)N1C[C@H](N=[N+]=[N-])C[C@@H]1C(=O)NC[C@H]1COC[C@H](C)O1
|
C=C=C[C@H]C)C=O)NC[C@H]N=[N+]=[N-])))C[C@@H]5C=O)NC[C@H]COC[C@H]C)O6
|
[C][=C][=C][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C@H1][Branch1][Ring2][N][=N+1][=N-1][C][C@@H1][Ring1][Branch2][C][=Branch1][C][=O][N][C][C@H1][C][O][C][C@H1][Branch1][C][C][O][Ring1][#Branch1]
|
N12CC(N=[N+]=[N-])CC15.C=C=CC(C)C2=O.C16COCC(C)O1.C35=O.N34.C46
|
C=CC[C@@H](C)C(=O)N1C[C@H](CNc2ncnc3c2cnn3CC)C(C)(C)C1
|
C=CC[C@@H]C)C=O)NC[C@H]CNcncncc6cnn5CC)))))))))))))CC)C)C5
|
[C][=C][C][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C@H1][Branch2][Ring1][C][C][N][C][=N][C][=N][C][=C][Ring1][=Branch1][C][=N][N][Ring1][Branch1][C][C][C][Branch1][C][C][Branch1][C][C][C][Ring2][Ring1][Ring2]
|
c16ncnc2c1cnn27.N14CC8C(C)(C)C1.C=CCC(C)C4=O.C58.N56.C7C
|
Cc1[nH]nc2c1C[C@@H](NC(=O)c1cccc(-n3cc(-c4cccs4)nn3)c1)CC2
|
Cc[nH]ncc5C[C@@H]NC=O)ccccc-ncc-ccccs5)))))nn5)))))c6))))))))CC6
|
[C][C][NH1][N][=C][C][=Ring1][Branch1][C][C@@H1][Branch2][Ring1][S][N][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][P][N][C][=C][Branch1][Branch2][C][=C][C][=C][S][Ring1][Branch1][N][=N][Ring1][#Branch2][=C][Ring1][S][C][C][Ring2][Ring1][=Branch2]
|
Cc1[nH]nc2c1CC6CC2.c17cccc8c1.n18cc9nn1.c19cccs1.C57=O.N56
|
CCCC(=CC(=O)N(C)CCC(=O)Nc1cc(C)ccc1O)CCC
|
CCCC=CC=O)NC)CCC=O)NcccC)ccc6O))))))))))))))CCC
|
[C][C][C][C][=Branch2][Ring1][=N][=C][C][=Branch1][C][=O][N][Branch1][C][C][C][C][C][=Branch1][C][=O][N][C][=C][C][Branch1][C][C][=C][C][=C][Ring1][#Branch1][O][C][C][C]
|
c15cc(C)ccc1O.CCCC=6CCC.C4CC3=O.C=6C2=O.N24C.N35
|
CCCCN1CCCC[C@H]1C(=O)N1C[C@@H](CNC(=O)Cn2nccn2)C(C)(C)C1
|
CCCCNCCCC[C@H]6C=O)NC[C@@H]CNC=O)Cnnccn5)))))))))CC)C)C5
|
[C][C][C][C][N][C][C][C][C][C@H1][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C@@H1][Branch1][#C][C][N][C][=Branch1][C][=O][C][N][N][=C][C][=N][Ring1][Branch1][C][Branch1][C][C][Branch1][C][C][C][Ring1][P]
|
N13CC9C(C)(C)C1.N15CCCCC17.n18nccn1.CCCC5.C4(=O)C8.C37=O.C69.N46
|
C#C[C@@]1(C(=O)N[C@H]2C=CCCC2)CCN(C(=O)Cc2ccccc2O)C1
|
C#C[C@@]C=O)N[C@H]C=CCCC6))))))))CCNC=O)Ccccccc6O)))))))))C5
|
[C][#C][C@@][Branch1][=C][C][=Branch1][C][=O][N][C@H1][C][=C][C][C][C][Ring1][=Branch1][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][Ring2][Ring1][Branch2]
|
C#CC16CCN4C1.c17ccccc1O.C15C=CCCC1.C4(=O)C7.C36=O.N35
|
CC(C)C[C@H](C)CC(=O)N1C[C@@]2(C(=O)N[C@@]3(C)CCCC(C)(C)C3)C[C@H]1CO2
|
CCC)C[C@H]C)CC=O)NC[C@@]C=O)N[C@@]C)CCCCC)C)C6))))))))C[C@H]5CO5
|
[C][C][Branch1][C][C][C][C@H1][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C@@][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][N][C@@][Branch1][C][C][C][C][C][C][Branch1][C][C][Branch1][C][C][C][Ring1][=Branch2][C][C@H1][Ring1][P][C][O][Ring1][P]
|
CC(C)CC(C)CC4=O.C16(C)CCCC(C)(C)C1.N14CC27CC1CO2.C57=O.N56
|
CC[C@@H](C(=O)N1CCC[C@@]12CCCN(C(=O)C=C(Cl)Cl)C2)n1ccc(C2CC2)n1
|
CC[C@@H]C=O)NCCC[C@@]5CCCNC=O)C=CCl)Cl))))C6)))))))))))ncccCCC3)))n5
|
[C][C][C@@H1][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C][C][C][C@@][Ring1][Branch1][C][C][C][N][Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][C][Cl][Cl][C][Ring1][N][N][C][=C][C][Branch1][=Branch1][C][C][C][Ring1][Ring1][=N][Ring1][Branch2]
|
N13CCCC12CCCN4C2.CCC5C3=O.C4(=O)C=C(Cl)Cl.n15ccc6n1.C16CC1
|
CO[C@H](CC(=O)N1CCC(c2cccc(Cl)c2Cl)CC1)C(F)(F)F
|
CO[C@H]CC=O)NCCCcccccCl)c6Cl)))))))CC6))))))))CF)F)F
|
[C][O][C@H1][Branch2][Ring1][N][C][C][=Branch1][C][=O][N][C][C][C][Branch1][=N][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1][Cl][C][C][Ring1][=C][C][Branch1][C][F][Branch1][C][F][F]
|
C4(CC3=O)C(F)(F)F.c15cccc(Cl)c1Cl.N13CCC5CC1.CO4
|
CCOC(=O)c1c(N2[C@H]3CC[C@@H]2C[C@H](CNC(=O)[C@@H](F)CC)C3)cc(C)nc1O
|
CCOC=O)ccN[C@H]CC[C@@H]5C[C@H]CNC=O)[C@@H]F)CC))))))C7))))))))ccC)nc6O
|
[C][C][O][C][=Branch1][C][=O][C][=C][Branch2][Ring1][O][N][C@H1][C][C][C@@H1][Ring1][Branch1][C][C@H1][Branch1][=N][C][N][C][=Branch1][C][=O][C@@H1][Branch1][C][F][C][C][C][Ring1][#C][C][=C][Branch1][C][C][N][=C][Ring2][Ring1][#Branch1][O]
|
c19c8cc(C)nc1O.N18C2CCC1CC%10C2.C5(=O)C(F)CC.C49=O.CC6.O46.C7%10.N57
|
O=C(CSC1CC1)NC1CCN(C(=O)c2cc(=O)c3ccc(O)cc3o2)CC1
|
O=CCSCCC3)))))NCCCNC=O)ccc=O)ccccO)cc6o%10)))))))))))CC6
|
[O][=C][Branch1][Branch2][C][S][C][C][C][Ring1][Ring1][N][C][C][C][N][Branch2][Ring1][=Branch2][C][=Branch1][C][=O][C][=C][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][O][Ring1][N][C][C][Ring2][Ring1][Ring2]
|
c18cc(=O)c2ccc(O)cc2o1.C17CCN5CC1.O=C4C6.C19CC1.C58=O.S69.N47
|
C=C(C)CNC(=O)[C@H](c1cc(C(F)F)nc(C)n1)N1Cc2cccnc2C1
|
C=CC)CNC=O)[C@H]cccCF)F))ncC)n6))))))NCccccnc6C9
|
[C][=C][Branch1][C][C][C][N][C][=Branch1][C][=O][C@H1][Branch2][Ring1][Ring1][C][=C][C][Branch1][=Branch1][C][Branch1][C][F][F][=N][C][Branch1][C][C][=N][Ring1][#Branch2][N][C][C][=C][C][=C][N][=C][Ring1][=Branch1][C][Ring1][=Branch2]
|
N15Cc2cccnc2C1.c16cc7nc(C)n1.C3(=O)C56.C=C(C)C4.C7(F)F.N34
|
CCC[C@H]1CN(C(=O)CCCC(F)(F)F)CCN1C(=O)c1cc(C)c(C)cc1Cl
|
CCC[C@H]CNC=O)CCCCF)F)F))))))CCN6C=O)cccC)cC)cc6Cl
|
[C][C][C][C@H1][C][N][Branch1][S][C][=Branch1][C][=O][C][C][C][C][Branch1][C][F][Branch1][C][F][F][C][C][N][Ring1][#C][C][=Branch1][C][=O][C][=C][C][Branch1][C][C][=C][Branch1][C][C][C][=C][Ring1][Branch2][Cl]
|
C2(=O)CCCC(F)(F)F.c14cc(C)c(C)cc1Cl.C15CN2CCN13.CCC5.C34=O
|
CCCS(=O)(=O)[C@H](C)C(=O)N[C@@H]1C[C@H]1CNC(=O)CCc1ccc(C)cc1C
|
CCCS=O)=O)[C@H]C)C=O)N[C@@H]C[C@H]3CNC=O)CCccccC)cc6C
|
[C][C][C][S][=Branch1][C][=O][=Branch1][C][=O][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C@@H1][C][C@H1][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][C][C][=C][C][=C][Branch1][C][C][C][=C][Ring1][#Branch1][C]
|
CCCS(=O)(=O)C(C)C2=O.c17ccc(C)cc1C.C3(=O)CC7.C15CC16.N25.C46.N34
|
CCCN1CCC[C@H](C(=O)NC[C@@]23CCC[C@@H](CN(C(=O)CC4CC4)C2)C3)C1
|
CCCNCCC[C@H]C=O)NC[C@@]CCC[C@@H]CNC=O)CCCC3)))))C8)))C6)))))))))C6
|
[C][C][C][N][C][C][C][C@H1][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C][C@@][C][C][C][C@@H1][Branch2][Ring1][C][C][N][Branch1][O][C][=Branch1][C][=O][C][C][C][C][Ring1][Ring1][C][Ring1][=C][C][Ring1][#C][C][Ring2][Ring1][=Branch2]
|
C12%10CCCC(CN6C1)C2.N17CCCC9C1.C6(=O)C%11.CCC7.C59=O.C1%11CC1.N58.C8%10
|
CN1CC=C(CC(=O)N[C@H]2C[C@H](CCNC(=O)c3cn(CC4CC4)nn3)C2)CC1
|
CNCC=CCC=O)N[C@H]C[C@H]CCNC=O)ccnCCCC3))))nn5)))))))))C4)))))))CC6
|
[C][N][C][C][=C][Branch2][Ring2][#Branch1][C][C][=Branch1][C][=O][N][C@H1][C][C@H1][Branch2][Ring1][#Branch1][C][C][N][C][=Branch1][C][=O][C][=C][N][Branch1][#Branch1][C][C][C][C][Ring1][Ring1][N][=N][Ring1][=Branch2][C][Ring2][Ring1][C][C][C][Ring2][Ring1][N]
|
CN1CC=C(CC5=O)CC1.c19cn%10nn1.C18CC%11C1.C%11C7.C69=O.C1%12CC1.N58.N67.C%10%12
|
O=C1CC[C@@H](C(=O)N[C@@H]2CN(C(=O)c3ccn(CC(F)(F)F)c(=O)c3)C[C@@H]2O)N1
|
O=CCC[C@@H]C=O)N[C@@H]CNC=O)cccnCCF)F)F)))c=O)c6)))))))C[C@@H]5O))))))))N5
|
[O][=C][C][C][C@@H1][Branch2][Ring2][N][C][=Branch1][C][=O][N][C@@H1][C][N][Branch2][Ring1][O][C][=Branch1][C][=O][C][C][=C][N][Branch1][#Branch2][C][C][Branch1][C][F][Branch1][C][F][F][C][=Branch1][C][=O][C][=Ring1][N][C][C@@H1][Ring2][Ring1][Ring1][O][N][Ring2][Ring1][N]
|
c18ccn9c(=O)c1.C16CN5CC1O.O=C1CCC7N1.C9C(F)(F)F.C47=O.C58=O.N46
|
COc1c(C(=O)N2C[C@H](NC(=O)c3cnc(N)c(N)c3)CC2(C)C)csc1C
|
COccC=O)NC[C@H]NC=O)ccncN)cN)c6))))))))CC5C)C)))))))csc5C
|
[C][O][C][C][Branch2][Ring2][=Branch1][C][=Branch1][C][=O][N][C][C@H1][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C][=C][N][=C][Branch1][C][N][C][Branch1][C][N][=C][Ring1][Branch2][C][C][Ring1][S][Branch1][C][C][C][=C][S][C][=Ring2][Ring1][=Branch2][C]
|
N14CC7CC1(C)C.c19cnc(N)c(N)c1.c16c8csc1C.C48=O.C59=O.CO6.N57
|
COC[C@H](C)C(=O)N1CCC[C@@H]1[C@H](C)NC(=O)CCC(C)(C)C
|
COC[C@H]C)C=O)NCCC[C@@H]5[C@H]C)NC=O)CCCC)C)C
|
[C][O][C][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C][C@@H1][Ring1][Branch1][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][C][C][Branch1][C][C][Branch1][C][C][C]
|
C3(=O)CCC(C)(C)C.C4C(C)C2=O.N12CCCC16.C56C.CO4.N35
|
CCN1CCCC[C@@H]1CNC(=O)[C@H]1CN(C(=O)[C@]2(C)CC2(C)C)CCN1C
|
CCNCCCC[C@@H]6CNC=O)[C@H]CNC=O)[C@]C)CC3C)C)))))CCN6C
|
[C][C][N][C][C][C][C][C@@H1][Ring1][=Branch1][C][N][C][=Branch1][C][=O][C@H1][C][N][Branch1][P][C][=Branch1][C][=O][C@][Branch1][C][C][C][C][Ring1][Ring2][Branch1][C][C][C][C][C][N][Ring1][=C][C]
|
C17CN4CCN1C.N15CCCCC19.C18(C)CC1(C)C.C37=O.C48=O.CC5.C69.N36
|
Cc1ccccc1CN(C)C(=O)CCN(C)C(=O)c1ncccc1N
|
Ccccccc6CNC)C=O)CCNC)C=O)cncccc6N
|
[C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][N][Branch1][C][C][C][=Branch1][C][=O][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][=N][C][=C][C][=C][Ring1][=Branch1][N]
|
Cc1ccccc17.c16ncccc1N.C2(=O)CC5.N24C.N35C.C36=O.C47
|
C[C@@H](F)CC(=O)NC1CCC2(CC1)CC(NC(=O)CSCC(F)F)C2
|
C[C@@H]F)CC=O)NCCCCCC6))CCNC=O)CSCCF)F)))))))C4
|
[C][C@@H1][Branch1][C][F][C][C][=Branch1][C][=O][N][C][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][C][C][Branch1][=C][N][C][=Branch1][C][=O][C][S][C][C][Branch1][C][F][F][C][Ring1][#C]
|
C17CCC2(CC1)CC8C2.CC(F)CC3=O.C4(=O)C5.C6C(F)F.N37.N48.S56
|
CCC(CC)(OC)C(=O)NCC12CCC(CC1)N(C(=O)C=Cc1ccco1)C2
|
CCCCC))OC))C=O)NCCCCCCC6))NC=O)C=Ccccco5))))))))C6
|
[C][C][C][Branch1][Ring1][C][C][Branch1][Ring1][O][C][C][=Branch1][C][=O][N][C][C][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][N][Branch1][=C][C][=Branch1][C][=O][C][=C][C][=C][C][=C][O][Ring1][Branch1][C][Ring1][P]
|
C128CCC(CC1)N4C2.CCC5(CC)C3=O.C=7c1ccco1.C4(=O)C=7.O5C.N36.C68
|
C#CC[C@](C)(CO)CNC(=O)[C@@H](CCOCCO)NC(=O)c1csnc1OC
|
C#CC[C@]C)CO))CNC=O)[C@@H]CCOCCO))))))NC=O)ccsnc5OC
|
[C][#C][C][C@][Branch1][C][C][Branch1][Ring1][C][O][C][N][C][=Branch1][C][=O][C@@H1][Branch1][#Branch1][C][C][O][C][C][O][N][C][=Branch1][C][=O][C][=C][S][N][=C][Ring1][Branch1][O][C]
|
C#CCC(C)(C7)CO.C2(=O)C8CC4.c19csnc16.C5CO.C39=O.N27.O45.N38.O6C
|
COC(=O)N1CC(CNC(=O)[C@H]2C=CCN2C(=O)c2ccc3cccnn23)C1
|
COC=O)NCCCNC=O)[C@H]C=CCN5C=O)cccccccnn96))))))))))))))))))C4
|
[C][O][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][#C][C][N][C][=Branch1][C][=O][C@H1][C][=C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][=C][C][=C][C][=C][C][=N][N][Ring1][=Branch2][Ring1][=Branch1][C][Ring2][Ring1][Branch2]
|
c1%10ccc2cccnn12.C19C=CCN17.N15CC%11C1.C45=O.C69=O.C7%10=O.CO4.C8%11.N68
|
C[C@]1(NC(=O)C2CC3(CC(O)C3)C2)C[C@H](NC(=O)c2ccc(F)c(N)c2)C1
|
C[C@]NC=O)CCCCCO)C4)))C4))))))C[C@H]NC=O)ccccF)cN)c6))))))))C4
|
[C][C@][Branch2][Ring1][=Branch1][N][C][=Branch1][C][=O][C][C][C][Branch1][=Branch2][C][C][Branch1][C][O][C][Ring1][Branch1][C][Ring1][Branch2][C][C@H1][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][F][C][Branch1][C][N][=C][Ring1][Branch2][C][Ring2][Ring1][#Branch2]
|
C18CC2(C1)CC(O)C2.c19ccc(F)c(N)c1.CC16CC7C1.C48=O.C59=O.N46.N57
|
COC(=O)C[C@@H](C)CC(=O)N1CCN(C(=O)CN2CCCCC2=O)C[C@@H](CO)C1
|
COC=O)C[C@@H]C)CC=O)NCCNC=O)CNCCCCC6=O)))))))))C[C@@H]CO))C7
|
[C][O][C][=Branch1][C][=O][C][C@@H1][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][N][C][C][C][C][C][Ring1][=Branch1][=O][C][C@@H1][Branch1][Ring1][C][O][C][Ring2][Ring1][Ring1]
|
C3(=O)CC(C)CC4=O.N14CCN5CC7C1.N16CCCCC1=O.C5(=O)C6.CO3.C7O
|
CCOC(=O)[C@@](C)(F)C(=O)N(C)C[C@H]1CN(C)CCO1
|
CCOC=O)[C@@]C)F)C=O)NC)C[C@H]CNC)CCO6
|
[C][C][O][C][=Branch1][C][=O][C@@][Branch1][C][C][Branch1][C][F][C][=Branch1][C][=O][N][Branch1][C][C][C][C@H1][C][N][Branch1][C][C][C][C][O][Ring1][#Branch1]
|
C2(=O)C(C)(F)C3=O.C16CN(C)CCO1.N35C.CC4.O24.C56
|
C#CCC1(NC(=O)[C@H]2COCC[C@H]2NC(=O)COC2(C)CCCC2)CCCCC1
|
C#CCCNC=O)[C@H]COCC[C@H]6NC=O)COCC)CCCC5)))))))))))))))))CCCCC6
|
[C][#C][C][C][Branch2][Ring1][#C][N][C][=Branch1][C][=O][C@H1][C][O][C][C][C@H1][Ring1][=Branch1][N][C][=Branch1][C][=O][C][O][C][Branch1][C][C][C][C][C][C][Ring1][=Branch1][C][C][C][C][C][Ring2][Ring1][#Branch2]
|
C17%10CCCCC1.C19COCCC18.C16(C)CCCC1.C4(=O)C5.C#CC%10.C39=O.N37.N48.O56
|
Cc1nc2n(c1C)CCN(C(=O)C(=O)N[C@H](C)c1cccc(Br)n1)C2
|
Ccncnc5C))CCNC=O)C=O)N[C@H]C)cccccBr)n6))))))))))C6
|
[C][C][N][=C][N][Branch1][Branch1][C][=Ring1][Branch1][C][C][C][N][Branch2][Ring1][=Branch2][C][=Branch1][C][=O][C][=Branch1][C][=O][N][C@H1][Branch1][C][C][C][=C][C][=C][C][Branch1][C][Br][=N][Ring1][#Branch1][C][Ring2][Ring1][=Branch1]
|
Cc1nc2n(c1C)CCN3C2.c16cccc(Br)n1.C3(=O)C4=O.C56C.N45
|
CCn1nnnc1[C@H](Nc1cnc(Cl)cc1CO)c1oc(C(F)(F)F)cc1Br
|
CCnnnnc5[C@H]NccncCl)cc6CO)))))))))cocCF)F)F))cc5Br
|
[C][C][N][N][=N][N][=C][Ring1][Branch1][C@H1][Branch1][#C][N][C][=C][N][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][O][C][O][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][C][=Ring1][=Branch2][Br]
|
c13cnc(Cl)cc18.c16oc7cc1Br.n14nnnc15.C7(F)(F)F.C256.CC4.N23.C8O
|
CCOCCCCC(=O)N1[C@H]2CCC[C@H]1CN(C(=O)CCN1CCOC1=O)C2
|
CCOCCCCC=O)N[C@H]CCC[C@H]6CNC=O)CCNCCOC5=O)))))))))C8
|
[C][C][O][C][C][C][C][C][=Branch1][C][=O][N][C@H1][C][C][C][C@H1][Ring1][=Branch1][C][N][Branch1][#C][C][=Branch1][C][=O][C][C][N][C][C][O][C][Ring1][Branch1][=O][C][Ring2][Ring1][C]
|
N13C2CCCC1CN4C2.C6CCCC3=O.N17CCOC1=O.C4(=O)CC7.CC5.O56
|
CC1=CC[C@H](Nc2ncnc(NCc3cnn(C(C)(C)C)c3)c2C)CC1
|
CC=CC[C@H]NcncncNCccnnCC)C)C))c5)))))))c6C))))))))CC6
|
[C][C][=C][C][C@H1][Branch2][Ring1][P][N][C][=N][C][=N][C][Branch2][Ring1][Ring2][N][C][C][C][=N][N][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][C][=Ring1][=Branch2][=C][Ring1][P][C][C][C][Ring2][Ring1][=Branch2]
|
c15ncnc6c1C.CC1=CCC7CC1.c19cnn8c1.C8(C)(C)C.N57.N46.C49
|
CC12C3C4C1C1C2C3C41C(=O)NCCCCC1CN(C(=O)[C@@]2(O)CCSC2)C1
|
CCCCC4CC6C6C64C=O)NCCCCCCNC=O)[C@@]O)CCSC5))))))C4
|
[C][C][C][C][C][Ring1][Ring2][C][C][Ring1][=Branch1][C][Ring1][=Branch1][C][Ring1][=Branch1][Ring1][Ring2][C][=Branch1][C][=O][N][C][C][C][C][C][C][N][Branch1][#C][C][=Branch1][C][=O][C@@][Branch1][C][O][C][C][S][C][Ring1][=Branch1][C][Ring1][N]
|
CC12C3C4C1C1C2C3C418.C19(O)CCSC1.C7CCC%10.C1%10CN6C1.C58=O.C69=O.N57
|
C[C@H](NC(=O)NC(C)(C)Cc1ccc(C(F)(F)F)cc1)c1noc(C(C)(C)C)n1
|
C[C@H]NC=O)NCC)C)CccccCF)F)F))cc6)))))))))))cnocCC)C)C))n5
|
[C][C@H1][Branch2][Ring1][P][N][C][=Branch1][C][=O][N][C][Branch1][C][C][Branch1][C][C][C][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][#Branch2][C][=N][O][C][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][=N][Ring1][=Branch2]
|
c18ccc9cc1.c16noc7n1.C5(C)(C)C8.C9(F)(F)F.C7(C)(C)C.CC46.C23=O.N24.N35
|
COC(=O)CCC(=O)N[C@@H]1CCCN(C(=O)c2ccc(CNS(C)(=O)=O)o2)CC1
|
COC=O)CCC=O)N[C@@H]CCCNC=O)ccccCNSC)=O)=O))))o5))))))CC7
|
[C][O][C][=Branch1][C][=O][C][C][C][=Branch1][C][=O][N][C@@H1][C][C][C][N][Branch2][Ring1][Branch2][C][=Branch1][C][=O][C][=C][C][=C][Branch1][O][C][N][S][Branch1][C][C][=Branch1][C][=O][=O][O][Ring1][O][C][C][Ring2][Ring1][Ring2]
|
C18CCCN5CC1.C3(=O)CCC4=O.c19ccc%10o1.S7(C)(=O)=O.C59=O.CO3.N48.C6%10.N67
|
CC1=CC[C@H](C(=O)N2C[C@H]3CCC[C@@](CNC(=O)Cc4cn(C)nn4)(C3)C2)CC1
|
CC=CC[C@H]C=O)NC[C@H]CCC[C@@]CNC=O)CccnC)nn5)))))))))C6)C8)))))))))CC6
|
[C][C][=C][C][C@H1][Branch2][Ring2][=Branch2][C][=Branch1][C][=O][N][C][C@H1][C][C][C][C@@][Branch2][Ring1][C][C][N][C][=Branch1][C][=O][C][C][=C][N][Branch1][C][C][N][=N][Ring1][=Branch1][Branch1][Ring2][C][Ring1][P][C][Ring2][Ring1][Ring2][C][C][Ring2][Ring1][N]
|
N15CC2CCCC%10(C2)C1.CC1=CCC8CC1.c19cn(C)nn1.C6(=O)C9.C58=O.C7%10.N67
|
CO[C@@H]1CN(C(=O)C2CC(F)C2)C[C@H]1NC(=O)CC(C)(C)c1cccs1
|
CO[C@@H]CNC=O)CCCF)C4)))))C[C@H]5NC=O)CCC)C)ccccs5
|
[C][O][C@@H1][C][N][Branch1][=C][C][=Branch1][C][=O][C][C][C][Branch1][C][F][C][Ring1][Branch1][C][C@H1][Ring1][N][N][C][=Branch1][C][=O][C][C][Branch1][C][C][Branch1][C][C][C][=C][C][=C][S][Ring1][Branch1]
|
C15CN3CC16.C4(=O)CC8(C)C.C17CC(F)C1.c18cccs1.C37=O.CO5.N46
|
CC(C)(C)NC(=O)[C@H](c1csc(S(N)(=O)=O)c1)N1CC[C@H]2[C@@H](C1)C2(F)F
|
CCC)C)NC=O)[C@H]ccscSN)=O)=O))c5)))))NCC[C@H][C@@H]C6)C3F)F
|
[C][C][Branch1][C][C][Branch1][C][C][N][C][=Branch1][C][=O][C@H1][Branch2][Ring1][C][C][=C][S][C][Branch1][=Branch2][S][Branch1][C][N][=Branch1][C][=O][=O][=C][Ring1][=Branch2][N][C][C][C@H1][C@@H1][Branch1][Ring2][C][Ring1][=Branch1][C][Ring1][Ring2][Branch1][C][F][F]
|
c16csc(S(N)(=O)=O)c1.N15CCC2C(C1)C2(F)F.C3(=O)C56.CC4(C)C.N34
|
CCC1(C(=O)N(C)CCN(C)CCO)CN(C(=O)C2=C(C)CCOC2)C1
|
CCCC=O)NC)CCNC)CCO))))))))CNC=O)C=CC)CCOC6)))))))C4
|
[C][C][C][Branch2][Ring1][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C][N][Branch1][C][C][C][C][O][C][N][Branch1][S][C][=Branch1][C][=O][C][=C][Branch1][C][C][C][C][O][C][Ring1][#Branch1][C][Ring2][Ring1][Branch2]
|
C4(=O)C1=C(C)CCOC1.C189CN4C1.C38=O.N35C.C5C6.N67C.C7CO.CC9
|
C[C@@H]1CCCN(C(=O)c2ccncc2)[C@H]1CNC(=O)[C@@]1(C)CCC(F)(F)C1
|
C[C@@H]CCCNC=O)cccncc6)))))))[C@H]6CNC=O)[C@@]C)CCCF)F)C5
|
[C][C@@H1][C][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][=C][C][=N][C][=C][Ring1][=Branch1][C@H1][Ring1][=C][C][N][C][=Branch1][C][=O][C@@][Branch1][C][C][C][C][C][Branch1][C][F][Branch1][C][F][C][Ring1][Branch2]
|
CC1CCCN3C18.C16(C)CCC(F)(F)C1.c17ccncc1.C37=O.C46=O.C58.N45
|
C#CC[C@H](O)C(=O)N[C@@H]1CC[C@@H]1NC(=O)c1cc(F)c(F)cc1NC(N)=O
|
C#CC[C@H]O)C=O)N[C@@H]CC[C@@H]4NC=O)cccF)cF)cc6NCN)=O
|
[C][#C][C][C@H1][Branch1][C][O][C][=Branch1][C][=O][N][C@@H1][C][C][C@@H1][Ring1][Ring2][N][C][=Branch1][C][=O][C][=C][C][Branch1][C][F][=C][Branch1][C][F][C][=C][Ring1][Branch2][N][C][Branch1][C][N][=O]
|
c18cc(F)c(F)cc15.C#CCC(O)C2=O.C16CCC17.C38=O.C4(N)=O.N26.N37.N45
|
Cc1cc(F)sc1C(=O)NC[C@H]1CC(C(=O)N(C)[C@H]2CCCNC2=O)=NO1
|
CcccF)sc5C=O)NC[C@H]CCC=O)NC)[C@H]CCCNC6=O)))))))))=NO5
|
[C][C][C][=C][Branch1][C][F][S][C][=Ring1][=Branch1][C][=Branch1][C][=O][N][C][C@H1][C][C][Branch2][Ring1][C][C][=Branch1][C][=O][N][Branch1][C][C][C@H1][C][C][C][N][C][Ring1][=Branch1][=O][=N][O][Ring1][S]
|
C18CC(C4=O)=NO1.Cc1cc(F)sc17.C16CCCNC1=O.C37=O.N46C.N35.C58
|
CN1CCN(C(=O)[C@H]2[C@@H]3C[C@@H]2N(S(=O)(=O)c2csc4ccccc24)C3)CCC1=O
|
CNCCNC=O)[C@H][C@@H]C[C@@H]4NS=O)=O)ccscccccc96))))))))))C5)))))))CCC7=O
|
[C][N][C][C][N][Branch2][Ring2][=Branch1][C][=Branch1][C][=O][C@H1][C@@H1][C][C@@H1][Ring1][Ring2][N][Branch2][Ring1][Branch1][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][S][C][=C][C][=C][C][=C][Ring1][=Branch2][Ring1][=Branch1][C][Ring1][P][C][C][C][Ring2][Ring1][O][=O]
|
S6(=O)(=O)c1csc2ccccc12.CN1CCN5CCC1=O.C17C2CC1N6C2.C57=O
|
CC(C)CC1(C(=O)NCC2(CC(=O)N(C)C[C@@](C)(O)C3CC3)CC2)CCC1
|
CCC)CCC=O)NCCCC=O)NC)C[C@@]C)O)CCC3))))))))CC3))))))CCC4
|
[C][C][Branch1][C][C][C][C][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][#Branch1][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C@@][Branch1][C][C][Branch1][C][O][C][C][C][Ring1][Ring1][C][C][Ring1][#C][C][C][C][Ring2][Ring1][#Branch1]
|
C189CCC1.C7C%12(C)O.CC(C)C9.C1%10%11CC1.C%11C5=O.C48=O.N57C.C1%12CC1.N46.C6%10
|
CC[C@H](C)[C@H](NC(=O)COCC1CC1)C(=O)N[C@]1(C)CCC(C)(C)C1
|
CC[C@H]C)[C@H]NC=O)COCCCC3))))))))C=O)N[C@]C)CCCC)C)C5
|
[C][C][C@H1][Branch1][C][C][C@H1][Branch1][=C][N][C][=Branch1][C][=O][C][O][C][C][C][C][Ring1][Ring1][C][=Branch1][C][=O][N][C@][Branch1][C][C][C][C][C][Branch1][C][C][Branch1][C][C][C][Ring1][Branch2]
|
CCC(C)C6C3=O.C17(C)CCC(C)(C)C1.C2(=O)C4.C18CC1.N26.O45.C58.N37
|
O=C(NC12CC(C(=O)N3CCC(CF)CC3)(C1)C2)[C@H]1CC2(CCC2)CO1
|
O=CNCCCC=O)NCCCCF))CC6)))))))C4)C4)))))[C@H]CCCCC4)))CO5
|
[O][=C][Branch2][Ring1][#C][N][C][C][C][Branch1][P][C][=Branch1][C][=O][N][C][C][C][Branch1][Ring1][C][F][C][C][Ring1][Branch2][Branch1][Ring2][C][Ring1][=C][C][Ring1][#C][C@H1][C][C][Branch1][=Branch1][C][C][C][Ring1][Ring2][C][O][Ring1][Branch2]
|
C17CC2(CCC2)CO1.N15CCC9CC1.C126CC8(C1)C2.O=C47.C58=O.N46.C9F
|
COCC(C)(C)C(=O)N[C@H](CNC(=O)c1cnc(O)s1)CC(C)C
|
COCCC)C)C=O)N[C@H]CNC=O)ccncO)s5))))))))CCC)C
|
[C][O][C][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][N][C@H1][Branch1][P][C][N][C][=Branch1][C][=O][C][=C][N][=C][Branch1][C][O][S][Ring1][=Branch1][C][C][Branch1][C][C][C]
|
C4C(C)(C)C2=O.C5(C6)CC(C)C.c17cnc(O)s1.C37=O.CO4.N25.N36
|
C=Cn1nncc1C(=O)N[C@H](CC)CCCC(=O)N1CC[C@@](O)(CC(C)C)C1
|
C=Cnnncc5C=O)N[C@H]CC))CCCC=O)NCC[C@@]O)CCC)C)))C5
|
[C][=C][N][N][=N][C][=C][Ring1][Branch1][C][=Branch1][C][=O][N][C@H1][Branch1][Ring1][C][C][C][C][C][C][=Branch1][C][=O][N][C][C][C@@][Branch1][C][O][Branch1][#Branch1][C][C][Branch1][C][C][C][C][Ring1][#Branch2]
|
C4(CC)CCCC3=O.C=Cn1nncc15.N13CCC6(O)C1.C6C(C)C.C25=O.N24
|
COC[C@@H](NC(=O)C12CC(NC(=O)CCc3ccsc3)(C1)C2)c1ccccc1
|
COC[C@@H]NC=O)CCCNC=O)CCcccsc5)))))))))C4)C4))))))cccccc6
|
[C][O][C][C@@H1][Branch2][Ring1][P][N][C][=Branch1][C][=O][C][C][C][Branch1][#C][N][C][=Branch1][C][=O][C][C][C][C][=C][S][C][=Ring1][Branch1][Branch1][Ring2][C][Ring1][=C][C][Ring1][#C][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
C129CC8(C1)C2.c1%10ccccc1.C5(=O)CC%11.c1%11ccsc1.C6C7%10.C49=O.CO6.N47.N58
|
CC1CC(CCC(=O)N2CC[C@H](NC(=O)C3=C(O)C([N+](=O)[O-])=CC(Cl)=C3)[C@@H]2C)C1
|
CCCCCCC=O)NCC[C@H]NC=O)C=CO)C[N+]=O)[O-]))=CCCl)=C6))))))))[C@@H]5C)))))))))C4
|
[C][C][C][C][Branch2][Ring2][=N][C][C][C][=Branch1][C][=O][N][C][C][C@H1][Branch2][Ring1][O][N][C][=Branch1][C][=O][C][=C][Branch1][C][O][C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][=C][C][Branch1][C][Cl][=C][Ring1][O][C@@H1][Ring2][Ring1][Ring1][C][C][Ring2][Ring1][N]
|
c17cc(Cl)cc([N+](=O)[O-])c1O.N14CCC6C1C.CC1CC8C1.C8CC4=O.C57=O.N56
|
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