SMILES
stringlengths 6
120
| Deep SMILES
stringlengths 6
124
| SELFIES
stringlengths 18
409
| SAFE
stringlengths 9
126
|
|---|---|---|---|
CCOC(C)(C)C(=O)N1CCN(CCNC(=O)C2(CO)CCOCC2)CC1
|
CCOCC)C)C=O)NCCNCCNC=O)CCO))CCOCC6))))))))))CC6
|
[C][C][O][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][N][C][C][N][Branch2][Ring1][Ring2][C][C][N][C][=Branch1][C][=O][C][Branch1][Ring1][C][O][C][C][O][C][C][Ring1][Branch2][C][C][Ring2][Ring1][Ring1]
|
N13CCN7CC1.C19%10CCOCC1.C6(C)(C)C3=O.C7C8.C49=O.CC5.O56.N48.C%10O
|
CN1C[C@@H](C(=O)NC2(CNC(=O)CCOc3cccc(C(N)=O)c3)CC2)CC1=O
|
CNC[C@@H]C=O)NCCNC=O)CCOcccccCN)=O))c6))))))))))))CC3)))))CC5=O
|
[C][N][C][C@@H1][Branch2][Ring2][#Branch1][C][=Branch1][C][=O][N][C][Branch2][Ring1][=Branch2][C][N][C][=Branch1][C][=O][C][C][O][C][=C][C][=C][C][Branch1][=Branch1][C][Branch1][C][N][=O][=C][Ring1][=Branch2][C][C][Ring2][Ring1][Ring1][C][C][Ring2][Ring1][O][=O]
|
CN1CC%10CC1=O.c17cccc%11c1.C5(=O)CC6.C18%12CC1.C4%10=O.C%11(N)=O.N48.C9%12.N59.O67
|
COCC[C@H](C)C(=O)N(C)C[C@@H](O)CNC(=O)c1ccccc1OC(C)C
|
COCC[C@H]C)C=O)NC)C[C@@H]O)CNC=O)cccccc6OCC)C
|
[C][O][C][C][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C@@H1][Branch1][C][O][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][Branch1][C][C][C]
|
C4CC(C)C2=O.c19ccccc16.C7C(O)C8.N27C.C39=O.C5(C)C.CO4.N38.O56
|
CCn1cnnc1[C@@H]1CN(C(=O)Nc2ccc3nc(O)oc3c2)CCO1
|
CCncnnc5[C@@H]CNC=O)NccccncO)oc5c9)))))))))))CCO6
|
[C][C][N][C][=N][N][=C][Ring1][Branch1][C@@H1][C][N][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][N][C][=C][C][=C][N][=C][Branch1][C][O][O][C][Ring1][=Branch1][=C][Ring1][#Branch2][C][C][O][Ring2][Ring1][Ring1]
|
c16ccc2nc(O)oc2c1.C18CN4CCO1.n17cnnc18.C45=O.CC7.N56
|
CCc1cnc(C(=O)NC[C@H]2CN(C(=O)[C@@H]3CC(=O)N(OC)C3)C(C)(C)C2)nc1
|
CCccncC=O)NC[C@H]CNC=O)[C@@H]CC=O)NOC))C5))))))CC)C)C5))))))))nc6
|
[C][C][C][=C][N][=C][Branch2][Ring2][=Branch2][C][=Branch1][C][=O][N][C][C@H1][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C@@H1][C][C][=Branch1][C][=O][N][Branch1][Ring1][O][C][C][Ring1][Branch2][C][Branch1][C][C][Branch1][C][C][C][Ring1][P][N][=C][Ring2][Ring1][O]
|
C19CN5C(C)(C)C1.C18CC(=O)N(OC)C1.c1%10cnc7nc1.C47=O.C58=O.CC%10.N46.C69
|
CN(CCOCCN(C)C(=O)c1c(N)cc(Cl)cc1Cl)C(=O)C[C@H]1CC1(C)C
|
CNCCOCCNC)C=O)ccN)ccCl)cc6Cl))))))))))))))C=O)C[C@H]CC3C)C
|
[C][N][Branch2][Ring1][=N][C][C][O][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][=C][Branch1][C][N][C][=C][Branch1][C][Cl][C][=C][Ring1][Branch2][Cl][C][=Branch1][C][=O][C][C@H1][C][C][Ring1][Ring1][Branch1][C][C][C]
|
c18c(N)cc(Cl)cc1Cl.C19CC1(C)C.C3(=O)C9.CN36.C6C4.C5C7.N27C.C28=O.O45
|
CCCCCCC[C@H](F)C(=O)N[C@H](CNC(=O)C[C@H]1CCC(=O)NC1)C(C)C
|
CCCCCCC[C@H]F)C=O)N[C@H]CNC=O)C[C@H]CCC=O)NC6))))))))))CC)C
|
[C][C][C][C][C][C][C][C@H1][Branch1][C][F][C][=Branch1][C][=O][N][C@H1][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][C@H1][C][C][C][=Branch1][C][=O][N][C][Ring1][#Branch1][C][Branch1][C][C][C]
|
CCCCCCCC(F)C2=O.C16CCC(=O)NC1.C4(C5)C(C)C.C3(=O)C6.N24.N35
|
CC(=CC(=O)N1C[C@H](CC(=O)N2C[C@@H]3CCC[C@H](O)[C@H]3C2)C[C@@H]1C)C(F)F
|
CC=CC=O)NC[C@H]CC=O)NC[C@@H]CCC[C@H]O)[C@H]6C9)))))))))))C[C@@H]5C))))))))CF)F
|
[C][C][=Branch2][Ring2][#Branch1][=C][C][=Branch1][C][=O][N][C][C@H1][Branch2][Ring1][=Branch1][C][C][=Branch1][C][=O][N][C][C@@H1][C][C][C][C@H1][Branch1][C][O][C@H1][Ring1][#Branch1][C][Ring1][#Branch2][C][C@@H1][Ring2][Ring1][C][C][C][Branch1][C][F][F]
|
N15CC2CCCC(O)C2C1.N14CC7CC1C.CC=6C(F)F.C=6C4=O.C7C5=O
|
CC1(C)CCc2c(C(=O)N3CC[C@@H]3CNC(=O)CCC3(C#N)CCC3)n[nH]c2C1
|
CCC)CCccC=O)NCC[C@@H]4CNC=O)CCCC#N))CCC4))))))))))))))n[nH]c5C9
|
[C][C][Branch1][C][C][C][C][C][C][Branch2][Ring1][=N][C][=Branch1][C][=O][N][C][C][C@@H1][Ring1][Ring2][C][N][C][=Branch1][C][=O][C][C][C][Branch1][Ring1][C][#N][C][C][C][Ring1][=Branch1][=N][NH1][C][=Ring2][Ring1][#Branch1][C][Ring2][Ring1][N]
|
CC1(C)CCc2c7n[nH]c2C1.C19(C#N)CCC1.N14CCC18.C5(=O)CC9.C47=O.C68.N56
|
Cn1ncnc1COCC(=O)N1CCO[C@@](C)(CNC(=O)C=Cc2cnc[nH]2)C1
|
Cnncnc5COCC=O)NCCO[C@@]C)CNC=O)C=Cccnc[nH]5))))))))))C6
|
[C][N][N][=C][N][=C][Ring1][Branch1][C][O][C][C][=Branch1][C][=O][N][C][C][O][C@@][Branch1][C][C][Branch1][S][C][N][C][=Branch1][C][=O][C][=C][C][=C][N][=C][NH1][Ring1][Branch1][C][Ring2][Ring1][C]
|
N13CCOC9(C)C1.Cn1ncnc1%10.C=8c1cnc[nH]1.C6C3=O.C4(=O)C=8.C5%10.O56.C79.N47
|
CCc1nc(C(=O)N2CCC[C@](O)(CN(C)C(=O)[C@@]3(O)CCOC3)C2)c(C)o1
|
CCcncC=O)NCCC[C@]O)CNC)C=O)[C@@]O)CCOC5))))))))C6)))))))cC)o5
|
[C][C][C][=N][C][Branch2][Ring2][#Branch1][C][=Branch1][C][=O][N][C][C][C][C@][Branch1][C][O][Branch2][Ring1][Ring2][C][N][Branch1][C][C][C][=Branch1][C][=O][C@@][Branch1][C][O][C][C][O][C][Ring1][=Branch1][C][Ring2][Ring1][C][=C][Branch1][C][C][O][Ring2][Ring1][#Branch2]
|
N14CCCC%10(O)C1.c19nc7c(C)o1.C18(O)CCOC1.C47=O.N56C.C58=O.CC9.C6%10
|
C=CCN(CCC(=O)N(C)[C@@H](C)C(=O)N(C)C)C(=O)[C@H](O)C1CCCC1
|
C=CCNCCC=O)NC)[C@@H]C)C=O)NC)C))))))))C=O)[C@H]O)CCCCC5
|
[C][=C][C][N][Branch2][Ring1][Branch2][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C][=Branch1][C][=O][C@H1][Branch1][C][O][C][C][C][C][C][Ring1][Branch1]
|
C6CC2=O.C7(C)C3=O.C4(=O)C8O.C18CCCC1.C=CC5.N456.N27C.N3(C)C
|
CCCC[C@@H](CC)C(=O)N1CCO[C@]2(CCN(C(=O)C(C)(C)CCC)C2)C1
|
CCCC[C@@H]CC))C=O)NCCO[C@]CCNC=O)CC)C)CCC)))))C5))))C6
|
[C][C][C][C][C@@H1][Branch1][Ring1][C][C][C][=Branch1][C][=O][N][C][C][O][C@][Branch2][Ring1][#Branch1][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C][C][C][C][Ring1][=N][C][Ring2][Ring1][C]
|
N13CCOC2(CCN4C2)C1.CCCCC(CC)C3=O.C4(=O)C(C)(C)CCC
|
CN(C)S(=O)(=O)NCC(=O)NC[C@H]1C[C@H]1NC(=O)Cc1sccc1Cl
|
CNC)S=O)=O)NCC=O)NC[C@H]C[C@H]3NC=O)Ccsccc5Cl
|
[C][N][Branch1][C][C][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][=Branch1][C][=O][N][C][C@H1][C][C@H1][Ring1][Ring1][N][C][=Branch1][C][=O][C][C][S][C][=C][C][=Ring1][Branch1][Cl]
|
CN(C)S(=O)(=O)N4.c17sccc1Cl.C4C2=O.C18CC16.C3(=O)C7.N25.C58.N36
|
Cc1ccc(C(=O)NCc2cccc3c2CCN(C(=O)c2ncc[nH]2)C3)n1C
|
CccccC=O)NCcccccc6CCNC=O)cncc[nH]5))))))C6)))))))))))))n5C
|
[C][C][=C][C][=C][Branch2][Ring2][C][C][=Branch1][C][=O][N][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][N][Branch1][N][C][=Branch1][C][=O][C][=N][C][=C][NH1][Ring1][Branch1][C][Ring1][=N][N][Ring2][Ring1][#Branch2][C]
|
c19cccc2c1CCN5C2.Cc1ccc7n1C.c18ncc[nH]1.C47=O.C58=O.N46.C69
|
Cc1cc([C@@H](C)NC(=O)C[C@H](N)Cc2ccccc2F)no1
|
Cccc[C@@H]C)NC=O)C[C@H]N)Ccccccc6F)))))))))))))no5
|
[C][C][=C][C][Branch2][Ring1][=Branch2][C@@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][C@H1][Branch1][C][N][C][C][=C][C][=C][C][=C][Ring1][=Branch1][F][=N][O][Ring2][Ring1][Branch1]
|
C3(=O)CC(N)C6.c16ccccc1F.Cc1cc5no1.C45C.N34
|
CCCC(=O)N[C@H]1CC[C@](F)(CNC(=O)c2c(Br)ccc(C)c2N)C1
|
CCCC=O)N[C@H]CC[C@]F)CNC=O)ccBr)cccC)c6N))))))))))C5
|
[C][C][C][C][=Branch1][C][=O][N][C@H1][C][C][C@][Branch1][C][F][Branch2][Ring1][=Branch1][C][N][C][=Branch1][C][=O][C][=C][Branch1][C][Br][C][=C][C][Branch1][C][C][=C][Ring1][Branch2][N][C][Ring2][Ring1][Ring1]
|
c17c(Br)ccc(C)c1N.C16CCC8(F)C1.CCCC3=O.C47=O.N36.C58.N45
|
C[C@H](NC(=O)[C@@H]1CC=C[C@H](O)C1)c1ccc(C2CC2)cc1
|
C[C@H]NC=O)[C@@H]CC=C[C@H]O)C6))))))))ccccCCC3)))cc6
|
[C][C@H1][Branch1][P][N][C][=Branch1][C][=O][C@@H1][C][C][=C][C@H1][Branch1][C][O][C][Ring1][#Branch1][C][=C][C][=C][Branch1][=Branch1][C][C][C][Ring1][Ring1][C][=C][Ring1][=Branch2]
|
C15CC=CC(O)C1.c16ccc7cc1.CC46.C35=O.C17CC1.N34
|
Cc1cccc(Br)c1NC(=O)C[C@H]1CC[C@@H](NCc2cc(Br)c(F)cc2O)CC1
|
CcccccBr)c6NC=O)C[C@H]CC[C@@H]NCcccBr)cF)cc6O)))))))))CC6
|
[C][C][=C][C][=C][C][Branch1][C][Br][=C][Ring1][#Branch1][N][C][=Branch1][C][=O][C][C@H1][C][C][C@@H1][Branch2][Ring1][C][N][C][C][=C][C][Branch1][C][Br][=C][Branch1][C][F][C][=C][Ring1][Branch2][O][C][C][Ring1][P]
|
c18cc(Br)c(F)cc1O.Cc1cccc(Br)c15.C17CCC6CC1.C3(=O)C7.N35.N46.C48
|
CC(C)(F)C(=O)NC[C@H](O)CNC(=O)Cc1c(F)ccc(Br)c1F
|
CCC)F)C=O)NC[C@H]O)CNC=O)CccF)cccBr)c6F
|
[C][C][Branch1][C][C][Branch1][C][F][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][O][C][N][C][=Branch1][C][=O][C][C][=C][Branch1][C][F][C][=C][C][Branch1][C][Br][=C][Ring1][Branch2][F]
|
c16c(F)ccc(Br)c1F.CC(C)(F)C2=O.C4C(O)C5.C3(=O)C6.N24.N35
|
C/C=C/C[C@@H](CC)C(=O)N1CCN(C)[C@H](CNC(=O)c2nc(C)sc2C)C1
|
C/C=C/C[C@@H]CC))C=O)NCCNC)[C@H]CNC=O)cncC)sc5C)))))))))C6
|
[C][/C][=C][/C][C@@H1][Branch1][Ring1][C][C][C][=Branch1][C][=O][N][C][C][N][Branch1][C][C][C@H1][Branch2][Ring1][C][C][N][C][=Branch1][C][=O][C][N][=C][Branch1][C][C][S][C][=Ring1][=Branch1][C][C][Ring2][Ring1][C]
|
C=7CC(CC)C3=O.N13CCN(C)C8C1.c16nc(C)sc1C.C46=O.CC=7.C58.N45
|
CCOC(=O)c1c(F)cccc1NC[C@H]1C(C)=CCC[C@H]1C
|
CCOC=O)ccF)cccc6NC[C@H]CC)=CCC[C@H]6C
|
[C][C][O][C][=Branch1][C][=O][C][=C][Branch1][C][F][C][=C][C][=C][Ring1][#Branch1][N][C][C@H1][C][Branch1][C][C][=C][C][C][C@H1][Ring1][#Branch1][C]
|
c16c5cccc1F.C17C(C)=CCCC1C.C26=O.CC3.O23.N45.C47
|
CC(=O)c1cccc(NC(=O)[C@H]2CN(C(=O)c3csc(C)c3C)CCO2)c1
|
CC=O)cccccNC=O)[C@H]CNC=O)ccscC)c5C)))))))CCO6))))))))c6
|
[C][C][=Branch1][C][=O][C][=C][C][=C][C][Branch2][Ring1][#C][N][C][=Branch1][C][=O][C@H1][C][N][Branch1][S][C][=Branch1][C][=O][C][=C][S][C][Branch1][C][C][=C][Ring1][=Branch1][C][C][C][O][Ring1][#C][=C][Ring2][Ring1][Branch2]
|
c18cccc6c1.C17CN5CCO1.c19csc(C)c1C.CC8=O.C47=O.C59=O.N46
|
Cc1nnsc1C(=O)N(C)C[C@@H]1CN(C(=O)[C@H]2COCC(C)(C)O2)CC12CC2
|
Ccnnsc5C=O)NC)C[C@@H]CNC=O)[C@H]COCCC)C)O6)))))))CC5CC3
|
[C][C][N][=N][S][C][=Ring1][Branch1][C][=Branch1][C][=O][N][Branch1][C][C][C][C@@H1][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C@H1][C][O][C][C][Branch1][C][C][Branch1][C][C][O][Ring1][Branch2][C][C][Ring1][#C][C][C][Ring1][Ring1]
|
C18CN4CC12CC2.C16COCC(C)(C)O1.Cc1nnsc17.C37=O.N35C.C46=O.C58
|
C=C[C@H]1C[C@H]1C(=O)N1CC2(C1)SCC[C@@H]2NC(=O)c1cc(SC)ccc1Cl
|
C=C[C@H]C[C@H]3C=O)NCCC4)SCC[C@@H]5NC=O)cccSC))ccc6Cl
|
[C][=C][C@H1][C][C@H1][Ring1][Ring1][C][=Branch1][C][=O][N][C][C][Branch1][Ring2][C][Ring1][Ring2][S][C][C][C@@H1][Ring1][=Branch1][N][C][=Branch1][C][=O][C][=C][C][Branch1][Ring1][S][C][=C][C][=C][Ring1][Branch2][Cl]
|
N13CC2(C1)SCCC25.c17cc8ccc1Cl.C=CC1CC16.C36=O.C47=O.N45.S8C
|
COC1(CC(=O)N(CC(F)F)C2CC2)CN(C(=O)C2=NOC(C)(C)C2)C1
|
COCCC=O)NCCF)F)))CCC3))))))CNC=O)C=NOCC)C)C5))))))C4
|
[C][O][C][Branch2][Ring1][Ring2][C][C][=Branch1][C][=O][N][Branch1][#Branch1][C][C][Branch1][C][F][F][C][C][C][Ring1][Ring1][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][=N][O][C][Branch1][C][C][Branch1][C][C][C][Ring1][#Branch1][C][Ring2][Ring1][Branch2]
|
C4(=O)C1=NOC(C)(C)C1.C158CN4C1.C8C3=O.C6C(F)F.N367.C17CC1.CO5
|
O=C(Nc1ccc(=NCc2cccc([N+](=O)[O-])c2Br)[nH]c1)c1c(Cl)cccc1Br
|
O=CNcccc=NCccccc[N+]=O)[O-]))c6Br)))))))))[nH]c6)))))))ccCl)cccc6Br
|
[O][=C][Branch2][Ring1][S][N][C][C][=C][C][=Branch2][Ring1][Ring1][=N][C][C][=C][C][=C][C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][=C][Ring1][=Branch2][Br][NH1][C][=Ring2][Ring1][C][C][=C][Branch1][C][Cl][C][=C][C][=C][Ring1][#Branch1][Br]
|
c16cccc([N+](=O)[O-])c1Br.c14ccc(=NC6)[nH]c1.c15c(Cl)cccc1Br.O=C35.N34
|
C=C(CCNC(=O)CC(C)(C)CC)CNC(=O)c1cn(C2CCCCC2)nn1
|
C=CCCNC=O)CCC)C)CC))))))))CNC=O)ccnCCCCCC6))))))nn5
|
[C][=C][Branch2][Ring1][C][C][C][N][C][=Branch1][C][=O][C][C][Branch1][C][C][Branch1][C][C][C][C][C][N][C][=Branch1][C][=O][C][=C][N][Branch1][=Branch2][C][C][C][C][C][C][Ring1][=Branch1][N][=N][Ring1][O]
|
C3(=O)CC(C)(C)CC.C=C(C6)CC5.c17cn8nn1.C18CCCCC1.C47=O.N35.N46
|
CC#CCCC(=O)NC[C@@H](CC(C)C)NC(=O)C1(C(F)F)CCOCC1
|
CC#CCCC=O)NC[C@@H]CCC)C)))NC=O)CCF)F))CCOCC6
|
[C][C][#C][C][C][C][=Branch1][C][=O][N][C][C@@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C][Branch1][=Branch1][C][Branch1][C][F][F][C][C][O][C][C][Ring1][=Branch2]
|
CC#CCCC2=O.C4C5CC(C)C.C167CCOCC1.C36=O.C7(F)F.N24.N35
|
O=C(C1=C[C@@H]2CCC[C@@H]12)N1CCC(OCCF)CC1
|
O=CC=C[C@@H]CCC[C@@H]75)))))))NCCCOCCF))))CC6
|
[O][=C][Branch1][N][C][=C][C@@H1][C][C][C][C@@H1][Ring1][#Branch1][Ring1][Branch1][N][C][C][C][Branch1][Branch1][O][C][C][F][C][C][Ring1][#Branch2]
|
O=C3C1=CC2CCCC12.N13CCC5CC1.C4CF.O45
|
O=C(N[C@@H]1CN(C(=O)c2cccc(O)c2Cl)CC2(CCC2)C1)c1nc(Cl)cs1
|
O=CN[C@@H]CNC=O)cccccO)c6Cl))))))))CCCCC4)))C6)))))))cncCl)cs5
|
[O][=C][Branch2][Ring2][Ring2][N][C@@H1][C][N][Branch1][P][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][C][O][=C][Ring1][#Branch1][Cl][C][C][Branch1][=Branch1][C][C][C][Ring1][Ring2][C][Ring2][Ring1][Ring1][C][=N][C][Branch1][C][Cl][=C][S][Ring1][=Branch1]
|
C15CN4CC2(CCC2)C1.c17cccc(O)c1Cl.c16nc(Cl)cs1.O=C36.C47=O.N35
|
Nc1ccc(O)c(C(=O)N2CC[C@]3(CCCCN(C(=O)Cn4cnnn4)C3)C2)c1
|
NccccO)cC=O)NCC[C@]CCCCNC=O)Cncnnn5)))))))C7))))))C5))))))c6
|
[N][C][=C][C][=C][Branch1][C][O][C][Branch2][Ring2][=Branch1][C][=Branch1][C][=O][N][C][C][C@][Branch2][Ring1][#Branch1][C][C][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][N][C][=N][N][=N][Ring1][Branch1][C][Ring1][#C][C][Ring2][Ring1][Ring1][=C][Ring2][Ring1][N]
|
N15CCC2(CCCCN6C2)C1.Nc1ccc(O)c7c1.n18cnnn1.C6(=O)C8.C57=O
|
CNC(=O)NCC(=O)NC[C@@H]1CCN(C(=O)c2ccoc2CC(=O)OC)C1
|
CNC=O)NCC=O)NC[C@@H]CCNC=O)cccoc5CC=O)OC))))))))))C5
|
[C][N][C][=Branch1][C][=O][N][C][C][=Branch1][C][=O][N][C][C@@H1][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][C][=C][O][C][=Ring1][Branch1][C][C][=Branch1][C][=O][O][C][C][Ring1][P]
|
C14CCN8C1.c1%11ccoc1%12.C9C7=O.C%12C3=O.C56=O.C8%11=O.CN5.N69.N7%10.C%104.O3C
|
CC(C)c1cc(C(=O)N[C@@H]2CC[C@H]3CCN(C(=O)[C@@H](F)C(C)C)[C@H]2C3)cc(O)n1
|
CCC)cccC=O)N[C@@H]CC[C@H]CCNC=O)[C@@H]F)CC)C))))[C@H]8C6)))))))))))ccO)n6
|
[C][C][Branch1][C][C][C][=C][C][Branch2][Ring2][C][C][=Branch1][C][=O][N][C@@H1][C][C][C@H1][C][C][N][Branch1][=C][C][=Branch1][C][=O][C@@H1][Branch1][C][F][C][Branch1][C][C][C][C@H1][Ring1][#C][C][Ring1][=N][=C][C][Branch1][C][O][=N][Ring2][Ring1][#Branch2]
|
C16CCC2CCN5C1C2.c18cc7cc(O)n1.C5(=O)C(F)C(C)C.CC8C.C47=O.N46
|
CC[C@H]1[C@H](NC(=O)C2CCC(CC#N)CC2)CCCN1C(=O)COCC1CCC1
|
CC[C@H][C@H]NC=O)CCCCCC#N)))CC6))))))))CCCN6C=O)COCCCCC4
|
[C][C][C@H1][C@H1][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C][C][C][C][Branch1][Ring2][C][C][#N][C][C][Ring1][=Branch2][C][C][C][N][Ring2][Ring1][C][C][=Branch1][C][=O][C][O][C][C][C][C][C][Ring1][Ring2]
|
C19C7CCCN14.C18CCC%10CC1.C4(=O)C5.C1%11CCC1.C38=O.C%10C#N.CC9.N37.O56.C6%11
|
COc1cc(CN2CC[C@@H]3CN(C(=O)c4occc4Br)CC[C@H]32)cc(O)c1O
|
COcccCNCC[C@@H]CNC=O)coccc5Br)))))))CC[C@H]69))))))))))ccO)c6O
|
[C][O][C][=C][C][Branch2][Ring1][=N][C][N][C][C][C@@H1][C][N][Branch1][=N][C][=Branch1][C][=O][C][O][C][=C][C][=Ring1][Branch1][Br][C][C][C@H1][Ring1][=C][Ring1][P][=C][C][Branch1][C][O][=C][Ring2][Ring1][=Branch2][O]
|
N17CCC2CN5CCC21.c16cc9cc(O)c1O.c18occc1Br.C58=O.CO6.C79
|
CC(C)Oc1cnc(N[C@@H]2CCN(C(=O)C[C@@H]3C[C@@H]3C)CCC2(F)F)nc1
|
CCC)OccncN[C@@H]CCNC=O)C[C@@H]C[C@@H]3C))))))CCC7F)F)))))))))nc6
|
[C][C][Branch1][C][C][O][C][=C][N][=C][Branch2][Ring1][N][N][C@@H1][C][C][N][Branch1][N][C][=Branch1][C][=O][C][C@@H1][C][C@@H1][Ring1][Ring1][C][C][C][C][Ring1][=C][Branch1][C][F][F][N][=C][Ring2][Ring1][#Branch1]
|
C18CCN4CCC1(F)F.c16cnc7nc1.C4(=O)C9.C19CC1C.CC5C.O56.N78
|
CCCSc1ccc(-c2nc([C@H](C)C3CC3)nn2CCC(=O)OC(C)(C)C)cc1
|
CCCScccc-cnc[C@H]C)CCC3))))nn5CCC=O)OCC)C)C)))))))))))cc6
|
[C][C][C][S][C][=C][C][=C][Branch2][Ring2][C][C][=N][C][Branch1][#Branch2][C@H1][Branch1][C][C][C][C][C][Ring1][Ring1][=N][N][Ring1][#Branch2][C][C][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][C][=C][Ring2][Ring1][=Branch2]
|
c1%10ccc%11cc1.c1%11nc8nn17.C7CC4=O.C5(C)(C)C.CCC6.C89C.C19CC1.S6%10.O45
|
CCOCCn1cc(C(=O)N2C[C@H](NC(=O)[C@@]3(C)CCCO3)CC[C@@H]2C)cn1
|
CCOCCnccC=O)NC[C@H]NC=O)[C@@]C)CCCO5)))))))CC[C@@H]6C))))))))cn5
|
[C][C][O][C][C][N][C][=C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C][C@H1][Branch1][S][N][C][=Branch1][C][=O][C@@][Branch1][C][C][C][C][C][O][Ring1][=Branch1][C][C][C@@H1][Ring1][#C][C][C][=N][Ring2][Ring1][#Branch1]
|
N14CC8CCC1C.n1%11cc%10cn1.C19(C)CCCO1.C7C%11.C4%10=O.C59=O.CC6.O67.N58
|
CCN1CCC[C@@H](NC(=O)[C@@H](CC(C)C)NC(=O)c2cnc(OC)s2)C1
|
CCNCCC[C@@H]NC=O)[C@@H]CCC)C)))NC=O)ccncOC))s5))))))))))C6
|
[C][C][N][C][C][C][C@@H1][Branch2][Ring1][#C][N][C][=Branch1][C][=O][C@@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C][=C][N][=C][Branch1][Ring1][O][C][S][Ring1][#Branch1][C][Ring2][Ring1][Branch2]
|
C3(=O)C7CC(C)C.N16CCCC8C1.c19cnc5s1.C49=O.CC6.N38.N47.O5C
|
Cc1ccn2c(C(=O)NCC[C@@H](C)N(C)C(=O)c3nn[nH]c3Cl)cnc2c1
|
CcccncC=O)NCC[C@@H]C)NC)C=O)cnn[nH]c5Cl)))))))))))))cnc5c9
|
[C][C][C][=C][N][C][Branch2][Ring1][N][C][=Branch1][C][=O][N][C][C][C@@H1][Branch1][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][N][=N][NH1][C][=Ring1][Branch1][Cl][=C][N][=C][Ring2][Ring1][=Branch1][C][=Ring2][Ring1][#Branch2]
|
Cc1ccn2c8cnc2c1.c19nn[nH]c1Cl.C6CC7C.C48=O.N57C.C59=O.N46
|
Cc1cc(C(=O)N2CCN(C(=O)Cc3cc(C)nn3C)[C@@H](C)[C@H]2C)cc(O)n1
|
CcccC=O)NCCNC=O)CcccC)nn5C))))))))[C@@H]C)[C@H]6C))))))))ccO)n6
|
[C][C][=C][C][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C][C][N][Branch1][P][C][=Branch1][C][=O][C][C][=C][C][Branch1][C][C][=N][N][Ring1][=Branch1][C][C@@H1][Branch1][C][C][C@H1][Ring1][P][C][=C][C][Branch1][C][O][=N][Ring2][Ring1][O]
|
N14CCN5C(C)C1C.Cc1cc6cc(O)n1.c17cc(C)nn1C.C5(=O)C7.C46=O
|
O=C(N[C@H]1C[C@@H](CO)N(C(=O)c2nccn3ccnc23)C1)c1ccc(F)s1
|
O=CN[C@H]C[C@@H]CO))NC=O)cnccnccnc95))))))))))C5))))))ccccF)s5
|
[O][=C][Branch2][Ring2][C][N][C@H1][C][C@@H1][Branch1][Ring1][C][O][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][=N][C][=C][N][C][=C][N][=C][Ring1][=Branch2][Ring1][Branch1][C][Ring2][Ring1][C][C][=C][C][=C][Branch1][C][F][S][Ring1][=Branch1]
|
c18nccn2ccnc12.C16CC9N5C1.c17ccc(F)s1.O=C47.C58=O.N46.C9O
|
C[C@@H](OCCN(C)C)C(=O)N[C@H]1CCN(C(=O)[C@@H]2CCS(=O)(=O)C2(C)C)C[C@@H]1O
|
C[C@@H]OCCNC)C)))))C=O)N[C@H]CCNC=O)[C@@H]CCS=O)=O)C5C)C)))))))C[C@@H]6O
|
[C][C@@H1][Branch1][=Branch2][O][C][C][N][Branch1][C][C][C][C][=Branch1][C][=O][N][C@H1][C][C][N][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][C@@H1][C][C][S][=Branch1][C][=O][=Branch1][C][=O][C][Ring1][#Branch1][Branch1][C][C][C][C][C@@H1][Ring1][P][O]
|
C19CCS(=O)(=O)C1(C)C.C18CCN4CC1O.CC5C3=O.C6C7.N7(C)C.C49=O.O56.N38
|
O=C(Cc1coc2ccccc12)N1C[C@H]2CCN(C(=O)[C@H]3COCCO3)[C@@H](C2)C1
|
O=CCccocccccc96))))))))))NC[C@H]CCNC=O)[C@H]COCCO6)))))))[C@@H]C6)C8
|
[O][=C][Branch1][#C][C][C][=C][O][C][=C][C][=C][C][=C][Ring1][=Branch2][Ring1][=Branch1][N][C][C@H1][C][C][N][Branch1][=N][C][=Branch1][C][=O][C@H1][C][O][C][C][O][Ring1][=Branch1][C@@H1][Branch1][Ring2][C][Ring1][=C][C][Ring1][P]
|
N14CC2CCN5C(C2)C1.c17coc2ccccc12.C16COCCO1.O=C4C7.C56=O
|
CC[C@H](CC(=O)NC[C@H]1CN(C(=O)C(=O)NCCC(N)=O)CC12CC2)OC
|
CC[C@H]CC=O)NC[C@H]CNC=O)C=O)NCCCN)=O)))))))CC5CC3)))))))))))OC
|
[C][C][C@H1][Branch2][Ring2][Branch1][C][C][=Branch1][C][=O][N][C][C@H1][C][N][Branch1][P][C][=Branch1][C][=O][C][=Branch1][C][=O][N][C][C][C][Branch1][C][N][=O][C][C][Ring1][#C][C][C][Ring1][Ring1][O][C]
|
C19CN4CC12CC2.CCC6CC3=O.C4(=O)C5=O.C8CC(N)=O.N37.C79.N58.O6C
|
CNc1ccc(C(=O)N2C[C@H](C(=O)N[C@H]3C[C@](C)(OC)C3(C)C)C(F)(F)C2)cc1
|
CNccccC=O)NC[C@H]C=O)N[C@H]C[C@]C)OC))C4C)C)))))))CF)F)C5))))))cc6
|
[C][N][C][=C][C][=C][Branch2][Ring2][N][C][=Branch1][C][=O][N][C][C@H1][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][N][C@H1][C][C@][Branch1][C][C][Branch1][Ring1][O][C][C][Ring1][#Branch1][Branch1][C][C][C][C][Branch1][C][F][Branch1][C][F][C][Ring2][Ring1][Ring1][C][=C][Ring2][Ring1][O]
|
N14CC9C(F)(F)C1.C18CC6(C)C1(C)C.c17ccc%10cc1.C4%10=O.C59=O.CN7.N58.O6C
|
CCCCCCC(=O)NC12CCC(CNC(=O)c3ccccc3)(CC1)OC2
|
CCCCCCC=O)NCCCCCNC=O)cccccc6)))))))))CC6))OC6
|
[C][C][C][C][C][C][C][=Branch1][C][=O][N][C][C][C][C][Branch1][#C][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][Branch1][Branch1][C][C][Ring1][S][O][C][Ring2][Ring1][C]
|
C127CCC9(CC1)OC2.CCCCCCC4=O.c18ccccc1.C58=O.N47.C69.N56
|
O=C(Nc1ccc(F)c(Cl)c1)[C@@H]1CCCN1C(=O)c1cc(Br)nc(Br)c1
|
O=CNccccF)cCl)c6)))))))[C@@H]CCCN5C=O)cccBr)ncBr)c6
|
[O][=C][Branch1][S][N][C][=C][C][=C][Branch1][C][F][C][Branch1][C][Cl][=C][Ring1][Branch2][C@@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][=C][C][Branch1][C][Br][=N][C][Branch1][C][Br][=C][Ring1][Branch2]
|
c14ccc(F)c(Cl)c1.c16cc(Br)nc(Br)c1.C15CCCN13.O=C25.C36=O.N24
|
Cc1cc(NC(=O)C[C@H]2CCN(S(=O)(=O)c3ccc(O)cc3)C2)ncc1F
|
CcccNC=O)C[C@H]CCNS=O)=O)ccccO)cc6)))))))C5))))))))ncc6F
|
[C][C][=C][C][Branch2][Ring2][Ring1][N][C][=Branch1][C][=O][C][C@H1][C][C][N][Branch2][Ring1][Ring1][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][C][Ring1][#C][=N][C][=C][Ring2][Ring1][=Branch2][F]
|
S5(=O)(=O)c1ccc(O)cc1.Cc1cc6ncc1F.C17CCN5C1.C4(=O)C7.N46
|
C#CCCCCC(=O)N[C@H]1CCCN(C(=O)C2=CCN(Cc3ccccc3)C2)C1
|
C#CCCCCC=O)N[C@H]CCCNC=O)C=CCNCcccccc6)))))))C5))))))C6
|
[C][#C][C][C][C][C][C][=Branch1][C][=O][N][C@H1][C][C][C][N][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][C][=C][C][N][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][N][C][Ring2][Ring1][Ring2]
|
C#CCCCCC4=O.C5(=O)C1=CCN6C1.C17CCCN5C1.c18ccccc1.N47.C68
|
Cn1ncc(C(=O)N2CCC[C@H](CNC(=O)C[C@H]3CCOC3)C2)c1-n1cnnc1
|
CnnccC=O)NCCC[C@H]CNC=O)C[C@H]CCOC5)))))))))C6)))))))c5-ncnnc5
|
[C][N][N][=C][C][Branch2][Ring1][=N][C][=Branch1][C][=O][N][C][C][C][C@H1][Branch1][#C][C][N][C][=Branch1][C][=O][C][C@H1][C][C][O][C][Ring1][Branch1][C][Ring1][S][=C][Ring2][Ring1][#Branch1][N][C][=N][N][=C][Ring1][Branch1]
|
Cn1ncc7c1%10.N14CCCC8C1.C19CCOC1.n1%10cnnc1.C5(=O)C9.C47=O.C68.N56
|
CCC(F)(F)CCNC(=O)C(C)(C)[C@H]1CCCN(C(=O)[C@H]2CCCCC(=O)N2)C1
|
CCCF)F)CCNC=O)CC)C)[C@H]CCCNC=O)[C@H]CCCCC=O)N7))))))))C6
|
[C][C][C][Branch1][C][F][Branch1][C][F][C][C][N][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C@H1][C][C][C][N][Branch1][P][C][=Branch1][C][=O][C@H1][C][C][C][C][C][=Branch1][C][=O][N][Ring1][Branch2][C][Ring1][S]
|
C16CCCCC(=O)N1.CCC(F)(F)CC5.C17CCCN4C1.C3(=O)C7(C)C.C46=O.N35
|
Cc1cc([C@H](C(=O)NC2COC2)N2CC[C@@H](CO)C[C@@H]2C)n[nH]1
|
Cccc[C@H]C=O)NCCOC4))))))NCC[C@@H]CO))C[C@@H]6C))))))))n[nH]5
|
[C][C][=C][C][Branch2][Ring1][N][C@H1][Branch1][N][C][=Branch1][C][=O][N][C][C][O][C][Ring1][Ring2][N][C][C][C@@H1][Branch1][Ring1][C][O][C][C@@H1][Ring1][Branch2][C][=N][NH1][Ring2][Ring1][=Branch1]
|
N14CCC7CC1C.Cc1cc6n[nH]1.C46C3=O.C15COC1.N35.C7O
|
CCCCC[C@@H](F)C(=O)N(C)[C@@H](C)CN(C)C(=O)C=CC=C(Cl)Cl
|
CCCCC[C@@H]F)C=O)NC)[C@@H]C)CNC)C=O)C=CC=CCl)Cl
|
[C][C][C][C][C][C@@H1][Branch1][C][F][C][=Branch1][C][=O][N][Branch1][C][C][C@@H1][Branch1][C][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][Cl][Cl]
|
CCCCCC(F)C1=O.C=5C=C(Cl)Cl.C3(C)C4.C2(=O)C=5.N13C.N24C
|
Cn1cc([C@@H]2C[C@H](n3cc(CC4(O)CCC4)nn3)CCO2)cn1
|
Cncc[C@@H]C[C@H]nccCCO)CCC4)))))nn5)))))CCO6))))))cn5
|
[C][N][C][=C][Branch2][Ring1][#C][C@@H1][C][C@H1][Branch2][Ring1][Ring2][N][C][=C][Branch1][O][C][C][Branch1][C][O][C][C][C][Ring1][Branch1][N][=N][Ring1][O][C][C][O][Ring1][P][C][=N][Ring2][Ring1][=Branch1]
|
C18CC7CCO1.Cn1cc8cn1.n17cc5nn1.C16(O)CCC1.C56
|
CC1(CC(=O)NC[C@@H]2CC[C@H]2NC(=O)CCSc2ccccc2)CC1
|
CCCC=O)NC[C@@H]CC[C@H]4NC=O)CCScccccc6)))))))))))))))))))CC3
|
[C][C][Branch2][Ring1][=C][C][C][=Branch1][C][=O][N][C][C@@H1][C][C][C@H1][Ring1][Ring2][N][C][=Branch1][C][=O][C][C][S][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][Ring2][Ring1][Branch2]
|
c1%10ccccc1.C19CCC17.C4(=O)CC6.CC18CC1.C8C3=O.N35.C59.N47.S6%10
|
C[C@@H]1C[C@@H](CNC(=O)CC(C)(C)O)CN1c1nc(Cl)ncc1Br
|
C[C@@H]C[C@@H]CNC=O)CCC)C)O))))))CN5cncCl)ncc6Br
|
[C][C@@H1][C][C@@H1][Branch1][S][C][N][C][=Branch1][C][=O][C][C][Branch1][C][C][Branch1][C][C][O][C][N][Ring1][=C][C][=N][C][Branch1][C][Cl][=N][C][=C][Ring1][#Branch1][Br]
|
c14nc(Cl)ncc1Br.CC1CC5CN14.C2(=O)CC(C)(C)O.C35.N23
|
CN1N=C(C(=O)N[C@@H]2CCN(C(=O)c3ccnc(O)c3F)C[C@@H]2F)CCC1=O
|
CNN=CC=O)N[C@@H]CCNC=O)cccncO)c6F))))))))C[C@@H]6F)))))))))CCC6=O
|
[C][N][N][=C][Branch2][Ring1][P][C][=Branch1][C][=O][N][C@@H1][C][C][N][Branch1][P][C][=Branch1][C][=O][C][=C][C][=N][C][Branch1][C][O][=C][Ring1][#Branch1][F][C][C@@H1][Ring1][S][F][C][C][C][Ring2][Ring1][#Branch2][=O]
|
CN1N=C(C4=O)CCC1=O.C16CCN5CC1F.c17ccnc(O)c1F.C57=O.N46
|
Cc1cc(C(=O)N2CCC[C@H]2C(=O)Nc2cnc(F)nc2)nnc1C
|
CcccC=O)NCCC[C@H]5C=O)NccncF)nc6))))))))))))))nnc6C
|
[C][C][=C][C][Branch2][Ring1][N][C][=Branch1][C][=O][N][C][C][C][C@H1][Ring1][Branch1][C][=Branch1][C][=O][N][C][=C][N][=C][Branch1][C][F][N][=C][Ring1][#Branch1][=N][N][=C][Ring2][Ring1][#Branch1][C]
|
Cc1cc7nnc1C.c15cnc(F)nc1.N13CCCC16.C37=O.C46=O.N45
|
C=CC1(C(=O)N2CCC[C@H]2C(=O)NCc2ccncc2CC)CCC1
|
C=CCC=O)NCCC[C@H]5C=O)NCcccncc6CC)))))))))))))))))CCC4
|
[C][=C][C][Branch2][Ring1][N][C][=Branch1][C][=O][N][C][C][C][C@H1][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][=C][C][=N][C][=C][Ring1][=Branch1][C][C][C][C][C][Ring2][Ring1][#Branch1]
|
c18ccncc19.C=CC17CCC1.N13CCCC16.C37=O.C46=O.N45.C58.C9C
|
CCc1ccc(C(=O)N2[C@H]3CC[C@H]2[C@@H](CNC(=O)c2ncc(CC)s2)C3)s1
|
CCccccC=O)N[C@H]CC[C@H]5[C@@H]CNC=O)cnccCC))s5))))))))C6))))))))s5
|
[C][C][C][=C][C][=C][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][C@H1][C][C][C@H1][Ring1][Branch1][C@@H1][Branch2][Ring1][C][C][N][C][=Branch1][C][=O][C][=N][C][=C][Branch1][Ring1][C][C][S][Ring1][#Branch1][C][Ring1][P][S][Ring2][Ring1][=Branch2]
|
N14C2CCC1C%11C2.c19ccc7s1.c18ncc%10s1.C47=O.C58=O.CC9.C6%11.N56.C%10C
|
COCC#CCN=c1[nH]c(=NC[C@@H](CO)c2ccc(Cl)cc2)[nH]c2c1SCC2
|
COCC#CCN=c[nH]c=NC[C@@H]CO))ccccCl)cc6)))))))))[nH]cc6SCC5
|
[C][O][C][C][#C][C][N][=C][NH1][C][=Branch2][Ring1][Ring1][=N][C][C@@H1][Branch1][Ring1][C][O][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][NH1][C][=C][Ring2][Ring1][C][S][C][C][Ring1][Branch1]
|
C3C#CCN=c1[nH]c(=NCC4CO)[nH]c2c1SCC2.c14ccc(Cl)cc1.CO3
|
COC(=O)[C@H]1CCC[C@@H](NC(=O)Nc2cccc3c2ccn3C(F)F)C1
|
COC=O)[C@H]CCC[C@@H]NC=O)Ncccccc6ccn5CF)F))))))))))))))C6
|
[C][O][C][=Branch1][C][=O][C@H1][C][C][C][C@@H1][Branch2][Ring1][=Branch2][N][C][=Branch1][C][=O][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][N][Ring1][Branch1][C][Branch1][C][F][F][C][Ring2][Ring1][=Branch1]
|
c17cccc2c1ccn2%10.C19CCCC8C1.C49=O.C56=O.C%10(F)F.CO4.N58.N67
|
CCOc1ccc(Cl)c(NC(=O)[C@@H]2C[C@H]2C(=O)OC(C)(C)C)c1
|
CCOccccCl)cNC=O)[C@@H]C[C@H]3C=O)OCC)C)C)))))))))c6
|
[C][C][O][C][=C][C][=C][Branch1][C][Cl][C][Branch2][Ring1][Branch2][N][C][=Branch1][C][=O][C@@H1][C][C@H1][Ring1][Ring1][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][=C][Ring2][Ring1][Ring2]
|
c17ccc(Cl)c8c1.C19CC1%10.C6(C)(C)C.C49=O.C3%10=O.CC5.O57.N48.O36
|
C[C@H](O)[C@@H]1C[C@H]1C(=O)N[C@]1(CO)CCCN(c2ncnc3sc4c(c23)CCC4)C1
|
C[C@H]O)[C@@H]C[C@H]3C=O)N[C@]CO))CCCNcncncsccc95)CCC5)))))))))))C6
|
[C][C@H1][Branch1][C][O][C@@H1][C][C@H1][Ring1][Ring1][C][=Branch1][C][=O][N][C@][Branch1][Ring1][C][O][C][C][C][N][Branch2][Ring1][Branch1][C][=N][C][=N][C][S][C][=C][Branch1][=Branch1][C][Ring1][=Branch2][=Ring1][Branch1][C][C][C][Ring1][=Branch1][C][Ring2][Ring1][Ring2]
|
c17ncnc2sc3c(c12)CCC3.C16%10CCCN7C1.C19CC18.CC9O.C58=O.N56.C%10O
|
O=C(CNC(=O)c1ccc(Br)s1)NCCCNS(=O)(=O)C1CC1
|
O=CCNC=O)ccccBr)s5))))))))NCCCNS=O)=O)CCC3
|
[O][=C][Branch1][P][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][Br][S][Ring1][=Branch1][N][C][C][C][N][S][=Branch1][C][=O][=Branch1][C][=O][C][C][C][Ring1][Ring1]
|
c18ccc(Br)s1.S7(=O)(=O)C1CC1.O=C2C4.C5CC6.C38=O.N34.N25.N67
|
C#CCC(C)(C)C(=O)N1CCO[C@@]2(CCCN(c3cc(C)c([N+](=O)[O-])cn3)C2)C1
|
C#CCCC)C)C=O)NCCO[C@@]CCCNcccC)c[N+]=O)[O-]))cn6))))))C6)))))C6
|
[C][#C][C][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][N][C][C][O][C@@][Branch2][Ring1][=N][C][C][C][N][Branch2][Ring1][Ring1][C][=C][C][Branch1][C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=N][Ring1][#Branch2][C][Ring1][S][C][Ring2][Ring1][Branch1]
|
N14CCOC2(CCCN5C2)C1.c15cc(C)c([N+](=O)[O-])cn1.C#CCC(C)(C)C4=O
|
Cc1ncoc1C(=O)N1CCC[C@@](C)(CNC(=O)c2cc[nH]c2C(C)C)C1
|
Ccncoc5C=O)NCCC[C@@]C)CNC=O)ccc[nH]c5CC)C))))))))))C6
|
[C][C][N][=C][O][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C][C@@][Branch1][C][C][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][C][=C][NH1][C][=Ring1][Branch1][C][Branch1][C][C][C][C][Ring2][Ring1][Ring1]
|
N13CCCC9(C)C1.Cc1ncoc16.c17cc[nH]c18.C36=O.C47=O.C8(C)C.C59.N45
|
CC/C=C/CC(=O)N(C)C[C@H](C)CNC(=O)C1(c2ccc(Br)cc2)CC1
|
CC/C=C/CC=O)NC)C[C@H]C)CNC=O)CccccBr)cc6))))))CC3
|
[C][C][/C][=C][/C][C][=Branch1][C][=O][N][Branch1][C][C][C][C@H1][Branch1][C][C][C][N][C][=Branch1][C][=O][C][Branch1][N][C][=C][C][=C][Branch1][C][Br][C][=C][Ring1][#Branch1][C][C][Ring1][#Branch2]
|
c19ccc(Br)cc1.C=8CC3=O.C5C(C)C6.C179CC1.CCC=8.N35C.C47=O.N46
|
COCC1(NC(=O)Cc2ccc(OC)c(Cl)c2)CN(C(=O)[C@@H](C)CC(C)(C)C)C1
|
COCCNC=O)CccccOC))cCl)c6)))))))))CNC=O)[C@@H]C)CCC)C)C)))))C4
|
[C][O][C][C][Branch2][Ring1][=Branch1][N][C][=Branch1][C][=O][C][C][=C][C][=C][Branch1][Ring1][O][C][C][Branch1][C][Cl][=C][Ring1][=Branch2][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C@@H1][Branch1][C][C][C][C][Branch1][C][C][Branch1][C][C][C][C][Ring2][Ring1][#Branch2]
|
C4(=O)C(C)CC(C)(C)C.c19ccc6c(Cl)c1.C178CN4C1.C3(=O)C9.CO5.C58.N37.O6C
|
Cc1cc(C(F)F)nn1CC(=O)NCC[C@@]1(C)CCN(C(=O)c2ccsc2)C1
|
CcccCF)F))nn5CC=O)NCC[C@@]C)CCNC=O)cccsc5))))))C5
|
[C][C][=C][C][Branch1][=Branch1][C][Branch1][C][F][F][=N][N][Ring1][Branch2][C][C][=Branch1][C][=O][N][C][C][C@@][Branch1][C][C][C][C][N][Branch1][N][C][=Branch1][C][=O][C][C][=C][S][C][=Ring1][Branch1][C][Ring1][=N]
|
Cc1cc8nn17.C19(C)CCN4C1.c16ccsc1.C7C3=O.C8(F)F.C5C9.C46=O.N35
|
C=CCCC1(C(=O)NCc2ncc(Cl)cn2)CN(C(=O)[C@@H](C)NC=O)C1
|
C=CCCCC=O)NCcnccCl)cn6)))))))))CNC=O)[C@@H]C)NC=O)))))C4
|
[C][=C][C][C][C][Branch2][Ring1][C][C][=Branch1][C][=O][N][C][C][=N][C][=C][Branch1][C][Cl][C][=N][Ring1][#Branch1][C][N][Branch1][N][C][=Branch1][C][=O][C@@H1][Branch1][C][C][N][C][=O][C][Ring2][Ring1][=Branch1]
|
c18ncc(Cl)cn1.C179CN4C1.C4(=O)C6C.C=CCC9.C37=O.N6C=O.N35.C58
|
Cc1cc(Cl)c(Cl)cc1C(=O)N1CC(NC(=O)[C@@H]2CCC[C@@H]2c2ccccc2)C1
|
CcccCl)cCl)cc6C=O)NCCNC=O)[C@@H]CCC[C@@H]5cccccc6)))))))))))))C4
|
[C][C][=C][C][Branch1][C][Cl][=C][Branch1][C][Cl][C][=C][Ring1][Branch2][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][Branch1][N][C][=Branch1][C][=O][C@@H1][C][C][C][C@@H1][Ring1][Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring2][Ring1][C]
|
Cc1cc(Cl)c(Cl)cc17.C16CCCC18.c18ccccc1.N13CC5C1.C37=O.C46=O.N45
|
Cn1cc(C[C@@H](O)C(=O)N2[C@H]3CC[C@@H]2C[C@H]3CNC(=O)Cc2cc[nH]c2)cn1
|
CnccC[C@@H]O)C=O)N[C@H]CC[C@@H]5C[C@H]6CNC=O)Cccc[nH]c5)))))))))))))))))))cn5
|
[C][N][C][=C][Branch2][Ring2][Ring1][C][C@@H1][Branch1][C][O][C][=Branch1][C][=O][N][C@H1][C][C][C@@H1][Ring1][Branch1][C][C@H1][Ring1][=Branch1][C][N][C][=Branch1][C][=O][C][C][C][=C][NH1][C][=Ring1][Branch1][C][=N][Ring2][Ring1][O]
|
N14C2CCC1C7C2.Cn1cc8cn1.C8C(O)C4=O.c19cc[nH]c1.C5(=O)C9.C67.N56
|
Cc1cc(C(=O)NC[C@@H]2C[C@H]2CNC(=O)[C@@H]2CCc3cccnc32)cn(C)c1=O
|
CcccC=O)NC[C@@H]C[C@H]3CNC=O)[C@@H]CCccccnc69))))))))))))))))))cnC)c6=O
|
[C][C][=C][C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C][C@@H1][C][C@H1][Ring1][Ring1][C][N][C][=Branch1][C][=O][C@@H1][C][C][C][=C][C][=C][N][=C][Ring1][=Branch1][Ring1][=Branch2][=C][N][Branch1][C][C][C][Ring2][Ring1][O][=O]
|
C5(=O)C1CCc2cccnc21.Cc1cc8cn(C)c1=O.C19CC1%10.C48=O.N46.C69.C7%10.N57
|
COCC(COC)C(=O)NC[C@H]1C[C@H]1NC(=O)Cc1cc(C2CC2)no1
|
COCCCOC)))C=O)NC[C@H]C[C@H]3NC=O)CcccCCC3)))no5
|
[C][O][C][C][Branch1][Ring2][C][O][C][C][=Branch1][C][=O][N][C][C@H1][C][C@H1][Ring1][Ring1][N][C][=Branch1][C][=O][C][C][=C][C][Branch1][=Branch1][C][C][C][Ring1][Ring1][=N][O][Ring1][Branch2]
|
C5C(C6)C3=O.c19cc%11no1.C1%10CC18.C4(=O)C9.C1%11CC1.CO5.O6C.N37.C7%10.N48
|
O=C1CC[C@H](C(=O)N2CC(F)(CNC(=O)c3ccnc(-n4cccn4)c3)C2)N1
|
O=CCC[C@H]C=O)NCCF)CNC=O)cccnc-ncccn5)))))c6)))))))))C4)))))N5
|
[O][=C][C][C][C@H1][Branch2][Ring2][=Branch2][C][=Branch1][C][=O][N][C][C][Branch1][C][F][Branch2][Ring1][Branch2][C][N][C][=Branch1][C][=O][C][=C][C][=N][C][Branch1][Branch2][N][C][=C][C][=N][Ring1][Branch1][=C][Ring1][O][C][Ring2][Ring1][Ring2][N][Ring2][Ring1][O]
|
c19ccnc%11c1.O=C1CCC8N1.N15CC%10(F)C1.n1%11cccn1.C58=O.C69=O.C7%10.N67
|
Cc1nc(-c2cccc(NC(=O)N(CCO)Cc3ccccc3Cl)c2)n[nH]1
|
Ccnc-cccccNC=O)NCCO)))Ccccccc6Cl)))))))))))c6))))))n[nH]5
|
[C][C][=N][C][Branch2][Ring2][C][C][=C][C][=C][C][Branch2][Ring1][=Branch1][N][C][=Branch1][C][=O][N][Branch1][Ring2][C][C][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl][=C][Ring2][Ring1][Branch1][=N][NH1][Ring2][Ring1][#Branch2]
|
c1%10cccc8c1.c19ccccc1Cl.Cc1nc%10n[nH]1.C45=O.N567.C6CO.N48.C79
|
Cc1[nH]nc(C(=O)N(C)[C@@H]2CCN(C(=O)c3cnns3)C2)c1F
|
Cc[nH]ncC=O)NC)[C@@H]CCNC=O)ccnns5))))))C5)))))))c5F
|
[C][C][NH1][N][=C][Branch2][Ring1][=N][C][=Branch1][C][=O][N][Branch1][C][C][C@@H1][C][C][N][Branch1][N][C][=Branch1][C][=O][C][=C][N][=N][S][Ring1][Branch1][C][Ring1][N][C][=Ring2][Ring1][Branch1][F]
|
Cc1[nH]nc7c1F.C16CCN5C1.c18cnns1.C47=O.N46C.C58=O
|
CC1(C)C[C@H](CC(=O)NC[C@H]2CCC[C@@H]2NC(=O)C2(C3CC3)CCOCC2)CO1
|
CCC)C[C@H]CC=O)NC[C@H]CCC[C@@H]5NC=O)CCCC3)))CCOCC6)))))))))))))))))CO5
|
[C][C][Branch1][C][C][C][C@H1][Branch2][Ring2][Ring1][C][C][=Branch1][C][=O][N][C][C@H1][C][C][C][C@@H1][Ring1][Branch1][N][C][=Branch1][C][=O][C][Branch1][=Branch1][C][C][C][Ring1][Ring1][C][C][O][C][C][Ring1][=Branch2][C][O][Ring2][Ring1][N]
|
C18(C2CC2)CCOCC1.CC1(C)CC9CO1.C1%10CCCC17.C9C4=O.C58=O.N46.C6%10.N57
|
C[C@@H]1CC[C@H](C(=O)NCCN(C(=O)c2nccc(N)c2Cl)C2CC2)O1
|
C[C@@H]CC[C@H]C=O)NCCNC=O)cncccN)c6Cl))))))))CCC3))))))))O5
|
[C][C@@H1][C][C][C@H1][Branch2][Ring1][S][C][=Branch1][C][=O][N][C][C][N][Branch1][P][C][=Branch1][C][=O][C][=N][C][=C][C][Branch1][C][N][=C][Ring1][#Branch1][Cl][C][C][C][Ring1][Ring1][O][Ring2][Ring1][Branch2]
|
c19nccc(N)c1Cl.CC1CCC8O1.C38=O.C5C6.N467.C49=O.C17CC1.N35
|
CC(C)[C@@H](C#N)C(=O)N1C[C@@H](CNC(=O)CCCCCS(N)(=O)=O)CC1(C)C
|
CCC)[C@@H]C#N))C=O)NC[C@@H]CNC=O)CCCCCSN)=O)=O))))))))))CC5C)C
|
[C][C][Branch1][C][C][C@@H1][Branch1][Ring1][C][#N][C][=Branch1][C][=O][N][C][C@@H1][Branch2][Ring1][Ring2][C][N][C][=Branch1][C][=O][C][C][C][C][C][S][Branch1][C][N][=Branch1][C][=O][=O][C][C][Ring2][Ring1][C][Branch1][C][C][C]
|
C3(=O)CCCCCS(N)(=O)=O.CC(C)C(C#N)C2=O.N12CC5CC1(C)C.C45.N34
|
C=CC1CCN(c2cc(C)c(S(=O)(=O)N[C@@H]3CCCSC3)cn2)CC1
|
C=CCCCNcccC)cS=O)=O)N[C@@H]CCCSC6))))))))cn6))))))CC6
|
[C][=C][C][C][C][N][Branch2][Ring1][=C][C][=C][C][Branch1][C][C][=C][Branch1][P][S][=Branch1][C][=O][=Branch1][C][=O][N][C@@H1][C][C][C][S][C][Ring1][=Branch1][C][=N][Ring1][P][C][C][Ring2][Ring1][#Branch1]
|
c15cc(C)c(S4(=O)=O)cn1.C=CC1CCN5CC1.C16CCCSC1.N46
|
C[C@H]1CCN(CC(=O)N2CCC[C@H](N(CCF)C(=O)CCNC(N)=O)C2)C1
|
C[C@H]CCNCC=O)NCCC[C@H]NCCF)))C=O)CCNCN)=O)))))))C6))))))))C5
|
[C][C@H1][C][C][N][Branch2][Ring2][Ring2][C][C][=Branch1][C][=O][N][C][C][C][C@H1][Branch2][Ring1][Ring1][N][Branch1][Ring2][C][C][F][C][=Branch1][C][=O][C][C][N][C][Branch1][C][N][=O][C][Ring2][Ring1][C][C][Ring2][Ring1][#Branch2]
|
N13CCCC9C1.CC1CCN6C1.C4(=O)CC8.C6C3=O.N479.C7CF.C5(N)=O.N58
|
C=CCCCCCCC(=O)NC[C@@H](C)C(=O)NCCNC(=O)N(C)C
|
C=CCCCCCCC=O)NC[C@@H]C)C=O)NCCNC=O)NC)C
|
[C][=C][C][C][C][C][C][C][C][=Branch1][C][=O][N][C][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][N][C][=Branch1][C][=O][N][Branch1][C][C][C]
|
C=CCCCCCCC1=O.C5C(C)C2=O.C6C7.C34=O.N4(C)C.N15.N26.N37
|
C[C@H]1C[C@H]1CC(=O)NCc1noc(-c2ccc(F)cc2)n1
|
C[C@H]C[C@H]3CC=O)NCcnoc-ccccF)cc6))))))n5
|
[C][C@H1][C][C@H1][Ring1][Ring1][C][C][=Branch1][C][=O][N][C][C][=N][O][C][Branch1][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][=N][Ring1][N]
|
c17ccc(F)cc1.c15noc7n1.CC1CC16.C6C3=O.N34.C45
|
C=CCN=C(NCCNC(=O)C(C)C)N1CC[C@@H](CC(N)=O)C1
|
C=CCN=CNCCNC=O)CC)C)))))))NCC[C@@H]CCN)=O)))C5
|
[C][=C][C][N][=C][Branch1][=C][N][C][C][N][C][=Branch1][C][=O][C][Branch1][C][C][C][N][C][C][C@@H1][Branch1][#Branch1][C][C][Branch1][C][N][=O][C][Ring1][=Branch2]
|
C=CCN=C(N3)N1CCC5C1.C2(=O)C(C)C.C5C(N)=O.C3C4.N24
|
O=C(CCc1cnccn1)N[C@H]1CC[C@@H](NC(=O)C[C@H]2CCCC[C@@H]2F)CC1
|
O=CCCccnccn6))))))))N[C@H]CC[C@@H]NC=O)C[C@H]CCCC[C@@H]6F))))))))))CC6
|
[O][=C][Branch1][O][C][C][C][=C][N][=C][C][=N][Ring1][=Branch1][N][C@H1][C][C][C@@H1][Branch1][S][N][C][=Branch1][C][=O][C][C@H1][C][C][C][C][C@@H1][Ring1][=Branch1][F][C][C][Ring1][P]
|
C15CCC6CC1.C18CCCCC1F.c17cnccn1.O=C3CC7.C4(=O)C8.N35.N46
|
CCOC(=O)[C@@H]1CN(C(=O)C2CCN(C(=O)c3nc(C)c[nH]3)CC2)CC[C@@H]1O
|
CCOC=O)[C@@H]CNC=O)CCCNC=O)cncC)c[nH]5))))))CC6)))))))CC[C@@H]6O
|
[C][C][O][C][=Branch1][C][=O][C@@H1][C][N][Branch2][Ring1][=N][C][=Branch1][C][=O][C][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][=N][C][Branch1][C][C][=C][NH1][Ring1][=Branch1][C][C][Ring1][=C][C][C][C@@H1][Ring2][Ring1][=Branch1][O]
|
C19CN5CCC1O.C1%10CCN6CC1.c18nc(C)c[nH]1.C49=O.C5%10=O.C68=O.CC7.O47
|
CC(C)[C@@H](C(=O)NCC[C@H]1CCN(C(=O)[C@H](C)NC(N)=O)C1)C1CCC1
|
CCC)[C@@H]C=O)NCC[C@H]CCNC=O)[C@H]C)NCN)=O)))))C5)))))))))CCCC4
|
[C][C][Branch1][C][C][C@@H1][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C][C][C@H1][C][C][N][Branch1][#C][C][=Branch1][C][=O][C@H1][Branch1][C][C][N][C][Branch1][C][N][=O][C][Ring1][=N][C][C][C][C][Ring1][Ring2]
|
CC(C)C7C2=O.C18CCN3C1.C3(=O)C6C.C17CCC1.C5C8.C4(N)=O.N25.N46
|
CC(C)[C@H](C(=O)N(C)[C@@H]1CCN(C(=O)[C@@H](F)C(C)(F)F)C1)n1cncn1
|
CCC)[C@H]C=O)NC)[C@@H]CCNC=O)[C@@H]F)CC)F)F))))C5)))))))ncncn5
|
[C][C][Branch1][C][C][C@H1][Branch2][Ring2][C][C][=Branch1][C][=O][N][Branch1][C][C][C@@H1][C][C][N][Branch1][P][C][=Branch1][C][=O][C@@H1][Branch1][C][F][C][Branch1][C][C][Branch1][C][F][F][C][Ring1][=N][N][C][=N][C][=N][Ring1][Branch1]
|
C3(=O)C(F)C(C)(F)F.CC(C)C5C2=O.C14CCN3C1.n15cncn1.N24C
|
CSc1ccc(C(=O)N2Cc3ccccc3[C@@H]2CNC(=O)[C@H]2C[C@@H]2C2CCC2)s1
|
CSccccC=O)NCcccccc6[C@@H]9CNC=O)[C@H]C[C@@H]3CCCC4))))))))))))))))))))s5
|
[C][S][C][=C][C][=C][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C@@H1][Ring1][=Branch2][C][N][C][=Branch1][C][=O][C@H1][C][C@@H1][Ring1][Ring1][C][C][C][C][Ring1][Ring2][S][Ring2][Ring1][O]
|
N14Cc2ccccc2C1C6.C18CC1C1CCC1.c19ccc7s1.C47=O.C58=O.CS9.N56
|
C[C@H](CNC(=O)c1ccc(=O)n(CCO)c1)N(C)C(=O)c1cc(C(C)(C)C)no1
|
C[C@H]CNC=O)cccc=O)nCCO)))c6)))))))))NC)C=O)cccCC)C)C))no5
|
[C][C@H1][Branch2][Ring1][#Branch1][C][N][C][=Branch1][C][=O][C][C][=C][C][=Branch1][C][=O][N][Branch1][Ring2][C][C][O][C][=Ring1][#Branch2][N][Branch1][C][C][C][=Branch1][C][=O][C][=C][C][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][=N][O][Ring1][=Branch2]
|
c17ccc(=O)n8c1.c16cc9no1.CC4C5.C9(C)(C)C.C27=O.C8CO.N34C.C36=O.N25
|
CCc1ncc(CN=c2ccnc(NC3CC(CCO)C3)[nH]2)[nH]1
|
CCcnccCN=cccncNCCCCCO)))C4)))))[nH]6))))))))[nH]5
|
[C][C][C][=N][C][=C][Branch2][Ring1][=Branch2][C][N][=C][C][=C][N][=C][Branch1][=N][N][C][C][C][Branch1][Ring2][C][C][O][C][Ring1][#Branch1][NH1][Ring1][=C][NH1][Ring2][Ring1][Branch1]
|
C7N=c1ccnc4[nH]1.c16ncc7[nH]1.C15CC8C1.C8CO.CC6.N45
|
CCC[C@H]1COCC[C@]1(NCCCOCC(F)F)c1nnnn1CC(F)F
|
CCC[C@H]COCC[C@]6NCCCOCCF)F))))))))cnnnn5CCF)F
|
[C][C][C][C@H1][C][O][C][C][C@][Ring1][=Branch1][Branch1][N][N][C][C][C][O][C][C][Branch1][C][F][F][C][=N][N][=N][N][Ring1][Branch1][C][C][Branch1][C][F][F]
|
C17COCCC148.c18nnnn16.C5CC2.C3C(F)F.C6C(F)F.CCC7.N45.O23
|
Cc1ccc(O[C@H](C)C(=O)N2CC[C@H](OC(F)F)C2)c(C)c1
|
CccccO[C@H]C)C=O)NCC[C@H]OCF)F)))C5))))))))cC)c6
|
[C][C][=C][C][=C][Branch2][Ring1][=Branch2][O][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C@H1][Branch1][#Branch1][O][C][Branch1][C][F][F][C][Ring1][=Branch2][C][Branch1][C][C][=C][Ring2][Ring1][Branch1]
|
Cc1ccc6c(C)c1.N13CCC5C1.C4(C)C3=O.O5C(F)F.O46
|
Cc1cc(O)nc(NNC(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)n1
|
CcccO)ncNNC=O)[C@@H]C)cccc[N+]=O)[O-]))cc6F)))))))))))n6
|
[C][C][=C][C][Branch1][C][O][=N][C][Branch2][Ring1][O][N][N][C][=Branch1][C][=O][C@@H1][Branch1][C][C][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][Ring1][=Branch2][F][=N][Ring2][Ring1][#Branch1]
|
Cc1cc(O)nc(NNC(=O)C3C)n1.c13ccc([N+](=O)[O-])cc1F
|
N#Cc1ccc(C(=O)CN2C[C@H](S(N)(=O)=O)CC23CCCC3)c(F)c1
|
N#CccccC=O)CNC[C@H]SN)=O)=O))CC5CCCC5)))))))))))cF)c6
|
[N][#C][C][=C][C][=C][Branch2][Ring1][=N][C][=Branch1][C][=O][C][N][C][C@H1][Branch1][=Branch2][S][Branch1][C][N][=Branch1][C][=O][=O][C][C][Ring1][=Branch2][C][C][C][C][Ring1][Branch1][C][Branch1][C][F][=C][Ring2][Ring1][#Branch1]
|
N14CC(S(N)(=O)=O)CC12CCCC2.N#Cc1ccc5c(F)c1.C5(=O)C4
|
Cc1ncc2n1C[C@H](C(=O)NC[C@@H]1CN(C(=O)[C@@H]3C[C@H]3F)CC[C@@H]1C)CC2
|
Ccnccn5C[C@H]C=O)NC[C@@H]CNC=O)[C@@H]C[C@H]3F)))))CC[C@@H]6C))))))))))CC6
|
[C][C][=N][C][=C][N][Ring1][Branch1][C][C@H1][Branch2][Ring1][N][C][=Branch1][C][=O][N][C][C@@H1][C][N][Branch1][O][C][=Branch1][C][=O][C@@H1][C][C@H1][Ring1][Ring1][F][C][C][C@@H1][Ring1][N][C][C][C][Ring2][Ring1][#Branch1]
|
Cc1ncc2n1CC7CC2.C19CN5CCC1C.C18CC1F.C47=O.C58=O.N46.C69
|
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