fabikru/half-of-chembl-2025-randomized-smiles-cleaned

smiles stringlengths 1 540
C1C(CCC(Nc2nc(nc(c2)N2CCOCC2)-n2nc(cc2)C)C1)(F)F
c1cc(ccc1Cl)N(C1SCCCN=1)C(C)=O
CC(=O)n1c2cc(=O)n(Cc3cnccc3)c(c2c(n1-c1ccccc1C)=O)C
c12c(ncn1C(C)C)c(nc(N1[C@H](CO)C[C@H](C1)O)n2)NCc1ccc(cc1)-c1ncccc1
NC1N=C(N)N(c2cccc(C[N+](C)(C)C)c2)C(N=1)(C)C
O=C(NCCCn1nc(C)nc1C)C(n1ccnc1C(C)C)C
c1nc2c(ncnc2n1[C@H]1[C@@H]([C@H](O)[C@@H](COP(=O)(OP(=O)(O)C(P(=O)(OP(=O)(O)OC[C@@H]2[C@@H](O)[C@H]([C@H](n3cnc4c3ncnc4N)O2)O)O)Cl)O)O1)O)N
c1(c(C)sc(c1)C(=O)O)CN1C[C@@](C)(OCC1)COC
c1c(-c2nc(ncc2I)N)c2cccc([N+](=O)[O-])c2[nH]1
N1(CCc2c3C(=O)C(=O)c4c(ccc5c4cccc5C)-c3oc2C1)CC(=O)OC
c1cc(N2C(=O)OC3(C2)CCN(Cc2c(-c4cnc(cc4)F)cc(c(Cl)c2)C)CC3)ccc1C(=O)O
c1cc(ccc1CCN1CCCC1)NC(c1ncccc1F)=O
C1CN(CCC1N1c2c(C(=NCC1=O)c1ccccc1)cc(Br)cc2)C
c1cccc(c1)N(CCO)CC(Nc1ccc(Cl)c(c1)S(=O)(=O)N1CCOCC1)=O
c12ccc([N+](C)(C)C)cc2c2C[C@@]3(O)C4N(CC[C@@]53[C@H](c2[nH]1)Oc1c(ccc(c51)C4)O)CC1CC1
c1c(c2c([n+](Cc3ccc(C(F)(F)F)cc3)c1)cc(Cl)cc2)N1CCCC1
c1(ccccc1)-c1nnc(NCCN2CCOCC2)c(C#N)c1
C(CCCCCCCCCCCCCCCCCC)C1Oc2c(c(C)c(c(c2S1)C)O)C
C(C1CC1)CCC(=O)NC[C@H]1CCN(C1)CC(F)F
O=C(O)c1c(cccc1)-n1c(c(C)c(C)c1C)C
[C@]12([C@@H]([C@H](C)CCCC(C)C)CC[C@H]1[C@H]1[C@@H]([C@@]3(C(CC1)[C@@H]([C@@H](CC3)O)Cc1ccc(Br)cc1)C)CC2)C
N(c1ccc(cc1)C(F)(F)F)c1cc(C(F)(F)F)nc2n1ncn2
C1=CC2C(C1C1C2C(N(C1=O)c1cc(C(C)=O)ccc1OCC)=O)=C(C)C
c1(CCNC(=NCCCOC)S)ccc(cc1)F
C1[C@H](c2ccccc2OC)CC2(CO1)[C@@H](N(CCO2)Cc1n[nH]c(n1)O)c1ccc(F)cc1
c1c(/C=C2\Cc3ccc(cc3C2=O)N)cc(Br)c(O)c1Br
c1(c(=O)[nH]c(cc1-c1ccc(cc1)OCC)-c1ccc2c(c1)OCO2)C#N
O(c1ccc2nc(n(c(=O)c2n1)C[C@@H]1CN(CCC1)C(C)C)C)c1ccc(cc1)F
c12CC3CCC(c2c2ccccc2[nH]1)N3CCCC(=O)c1ccccc1
c1nc(CN2CCC(C2)N(Cc2noc(CC)n2)C(=O)C)cnc1C
c1ccccc1CC1(NC(N(CC(=O)NC(C)C23CC4CC(CC(C4)C3)C2)C1=O)=O)Cc1ccccc1
c12[C@H]3N(C)CCc2c(OC)c2OCOc2c1-c1cc(OC)c(cc1C3)OC
c1cc2ccc(cc2cc1)NS(c1ccc(NCc2c(O)c(ccc2)OC)cc1)(=O)=O
c1cccc(c1)CCC(=O)Nc1ccnn1C1CCN(CC1)Cc1c(n(nc1)C)C
n1c(noc1CN(C)C(c1cccc(c1)S(=O)(=O)N1CCNCC1)=O)C
O(C(=O)c1ccccc1)N(c1ccc(C(c2ccccc2)=O)cc1)C(=O)c1ccc(c(c1)OC)OC
C1C(C1)COc1c(CN[C@@H]2CN(CCC2)c2[nH]c3ccc(Cl)nc3n2)cc(cc1Cl)Cl
N1(S(c2ccc(cc2)NC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)(=O)=O)CCN(CC1)C
C(c1ccccc1)[C@@H](C(=O)N[C@@H](CCC(N)=O)C(=O)OCCCC=C)NC([C@@H](NC(=O)/C=C/c1ccccc1)[C@@H](C)O)=O
O=C1c2c3c(ccc2OCC1c1ccccc1)cccc3
C1(c2n(C)ccn2)CCNC1
O(S(=O)(N)=O)c1ccc2cc(-c3ccc(cc3)OS(N)(=O)=O)n(CCCCCCCCCC)c2c1
[O-][Cl+3]([O-])([O-])[O-].c1cc(ccc1)-c1[n+](c(cc(-c2ccccc2)c1)C)CCc1ccccc1
c1(n(-c2ccc(cc2)OC)nnn1)C(N1CCN(CC1)C/C=C/c1ccccc1)CC
N1(CCc2ccccc2C1c1ccccc1)C(NCCOC)=O
O=C(Nc1ccc(NC(=N)c2ncccc2)cc1F)c1ccc(c(F)c1)NC(c1ncccc1)=N
C1[C@@H]2N(C[C@H]1N(C2)c1nc(nc(c1)-c1cnc(N)nc1)N1CC[C@@](C)(C1)F)CC(F)F
c1(c(ccc2c1oc(cc2C(F)(F)F)=O)OCCCCCCCCCCCC)C
Fc1cccc(NC(CN(C(C2CC(N(Cc3ccccc3)C2)=O)=O)C)=O)c1
c1(c(c2ccc(OCCOc3c(S(=O)(=O)c4ccccc4)[n+](on3)[O-])cc2oc1=O)C)C(C)C
C1CN(c2c(c(ccc2)Cl)OC)CCN1CCCCNC(=O)c1c2CCc3ccc(cc3)CCc(c1)cc2
c1(cc(ccc1Cl)NC(=O)c1ccncc1)[N+]([O-])=O
C([C@H]1CC[C@H](c2ccc(C3Nc4c(ncnc4OC3(C)C)N)cc2)CC1)C(=O)O
c1c(c(F)ccc1OCC(=O)Nc1ccc(C(F)(F)F)cc1)F
c12ccc(cc2Sc2cc(O)ccc2N1C(C)=O)[N+]([O-])=O
C(Nc1c(N2CCCC2)cccc1)(=O)c1cnccc1
C(c1ccc(s1)-c1cc(ccc1)F)(=O)N(C)Cc1cccc(c1)O
N(C(=O)c1noc(c1[N+]([O-])=O)C)c1cc(ccc1OC)Cl
C[C@H]1[C@](CN(C1=O)c1c(cccc1C)C)(C(C)C)C(Nc1cc(cc(NC(C)C)c1)C(F)(F)F)=O
c1c(cc(CNC(C(F)(F)F)=O)c(F)c1)-c1nc2c(c(nc(n2)N2[C@@H](C)COCC2)N2[C@H](COCC2)C)cc1
C(C)(C)(C)[C@H](NC([C@H](C(C)(C)C)NC([C@@H]1N(C(C)C)CC1)=O)=O)C(N1C[C@]2(C3(C2(C)C)CCC3)C[C@H]1C(N[C@@]1(C(NS(=O)(N2CCCC2)=O)=O)[C@H](C=C)C1)=O)=O
NC(=N)NCCC[C@H](NC([C@H](CCCCN)NC(=O)[C@@H](NC([C@H](C(C)C)NC(=O)[C@@H](NC([C@H](CC(C)C)NC([C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@@H](N)C)CCCCN)CC(C)C)=O)=O)CCCCN)=O)CC(C)C)=O)C(N[C@@H](Cc1ccccc1)C(=O)N)=O
c1ccc2c(c1NC(C(=O)Nc1cccc3c1nccc3NC(CCCN(CC)CC)C)=O)nccc2NC(CCCN(CC)CC)C
c1c(C[C@H]2C(N[C@H](C(N[C@H](C(=O)NCC(O)=O)CO)=O)CSSC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(CNC([C@@H](NC(=O)CN3CCN(CCN(CCN(CC3)CC(=O)O)CC(=O)O)CC(O)=O)C)=O)=O)CCCC)C(N[C@@H](Cc3ccccc3)C(N[C@H](C(N[C@H](Cc3c[nH]c4ccccc34)C(N[C@@H](CCCCN)C(N[C@@H]([C@H](O)C)C(N2)=O)=O)=O)=O)Cc2ccccc2)=O)=O)=O)cccc1
c1c(cn(n1)Cc1ccccc1)C(NCCc1ccc2c(c1)OCO2)=O
n1([C@@H]2O[C@H](COP(O)(O)=O)[C@@H](O)[C@H]2Cl)c(=O)[nH]c(=O)c(C)c1
C(C)(C)(c1ccc(C#Cc2ccc(-n3c(nc4ccccc4c3=O)/C=C/c3ccc(o3)[N+](=O)[O-])c(c2)C)cc1)C
c1c2N(C(=O)C3(CCN(CC4CC4)CC3)Nc2ccc1)CC(C)(C)C
n1c2CCCCCn2nc1CNc1c(ccc(c1)C)C
c1(C)cc([Se]C(c2c(F)cc(cc2)F)Cn2ccnc2)cc(C)c1
c1(=O)c2cc(ccc2ncn1CCN1CCCCC1)NC(=O)Nc1cc(C(=O)C)ccc1
c12c(c3c(cccc3)oc1=O)n(nc2)CC(NC(C(=O)OC)CCSC)=O
C1CCCC(C1)[C@@H](N1Cc2c(ccc(Oc3ccccc3)c2)N=C1N)CCC(=O)N(C1CCCCC1)C(c1nc(sc1)C)C
c1(cc(ccc1C(C)C)C)OCCNC(c1c(cccc1)O)=O
C1C(n2nnc(C(C)O)c2)CCN(C(C2(c3ccc(C)cc3)CC2)=O)C1
C(=O)(CN1CCN(C)CC1)Nc1c2Cc3c([nH]nc3-c2ccc1)-c1csc(C#CCOc2ccccc2)c1
C1(=O)CCCC(N2CCCC2)=C1
s1c2ncnc(N3CCN(CC3)S(=O)(=O)c3ccc(cc3)C)c2cc1
C1(C)N(CCc2cc(c(OC)cc12)OC)S(=O)(c1cc(c(nc1)Cl)Cl)=O
[C@H]12c3cc(ccc3O[C@@](N(c3c(OC)cc(OC)cc3)C(=O)N2)(C)C1)Cl
c1(ccc2c(c1)c(no2)N)-n1c2c(c(n1)C)ncn(-c1ccc(-c3ccccc3CN3CC[C@H](O)C3)cc1)c2=O
c1cc(cnc1C(/C=C/c1c(F)cccc1F)=O)N1CC=CC1
C(c1c(cccc1)NC(=O)c1nc2CCN(C)Cc2s1)C(Nc1ncc(cc1)Cl)=O
O=Cc1cc(cc(c1O)-c1cc(c(O)cc1)CC=C)CC=C
C(NCCC[C@@H](C(=O)O)N/C(=C1/C([C@]2(C(Oc3c(c(O)c(c(c32)O)C)C(C)=O)=CC1=O)C)=O)C)(N)=N
Cc1onc(NC(CN2CC(C)CCC2)=O)c1
c1ccc(/N=C(/N=c2\snc(C)n2Cc2ccc(cc2)F)c2ccccc2)cc1
c1(ccccc1)C(OC[C@@H]1[C@@](C)([C@@](F)([C@@H](O1)n1c2c(c(NCc3ccco3)ncn2)nc1)C)OC(=O)C)=O
c1(cc(ccc1C)C(=O)N1CCN(c2cccc(c2)C(F)(F)F)CC1)C
c1c(ccc(S(=O)(N2CCC(CC2)C(NCC)=O)=O)c1)OC
c12c(cc(n1CC(F)(F)F)C(=O)N1CCOCC1)cc(cc2)OC1CCN(C2CCC2)CC1
C1CCCC(C[C@H](NC([C@H](CC(=O)NO)CCCc2ccc(cc2)Cl)=O)C(=O)NCCc2ccccc2)C1
c1cn2c(C(OC(C)=O)=C(c3ccccc3)[S+](c3ccccc3-2)[O-])c1
c1c([nH]c(c1)-c1cnc2c(n1)C(C)(C)CCC2(C)C)-c1ccc(cc1)C(=O)O
C1(N(CCOC1)Cc1nc(sc1)C)c1c(cn[nH]1)C
c1cc(c2c(cc(C)cc2)c1)C
c1(/C=N/Nc2nc3c([nH]2)cccc3)c2c([nH]c1)cccc2
CN(C)c1ncc(-c2c(noc2C)-c2cc(OC)c(c(OC)c2)OC)cc1
N(C(c1cn2c(nc1)ncc2)=O)Cc1ccc(cc1)S(=O)(c1cccc(c1)C(F)(F)F)=O
c1(C[C@H]2NC([C@@H]3CCCN3C(=O)[C@H](N(C(=O)[C@@H]3CCC=NN3C(=O)[C@@H]3N(C([C@H]([C@H](C)CC)NC2=O)=O)N=CCC3)C)Cc2ccccc2)=O)ccccc1

C1C(CCC(Nc2nc(nc(c2)N2CCOCC2)-n2nc(cc2)C)C1)(F)F

c1cc(ccc1Cl)N(C1SCCCN=1)C(C)=O

CC(=O)n1c2cc(=O)n(Cc3cnccc3)c(c2c(n1-c1ccccc1C)=O)C

c12c(ncn1C(C)C)c(nc(N1[C@H](CO)C[C@H](C1)O)n2)NCc1ccc(cc1)-c1ncccc1

NC1N=C(N)N(c2cccc(C[N+](C)(C)C)c2)C(N=1)(C)C

O=C(NCCCn1nc(C)nc1C)C(n1ccnc1C(C)C)C

c1nc2c(ncnc2n1[C@H]1[C@@H]([C@H](O)[C@@H](COP(=O)(OP(=O)(O)C(P(=O)(OP(=O)(O)OC[C@@H]2[C@@H](O)[C@H]([C@H](n3cnc4c3ncnc4N)O2)O)O)Cl)O)O1)O)N

c1(c(C)sc(c1)C(=O)O)CN1C[C@@](C)(OCC1)COC

c1c(-c2nc(ncc2I)N)c2cccc([N+](=O)[O-])c2[nH]1

N1(CCc2c3C(=O)C(=O)c4c(ccc5c4cccc5C)-c3oc2C1)CC(=O)OC

c1cc(N2C(=O)OC3(C2)CCN(Cc2c(-c4cnc(cc4)F)cc(c(Cl)c2)C)CC3)ccc1C(=O)O

c1cc(ccc1CCN1CCCC1)NC(c1ncccc1F)=O

C1CN(CCC1N1c2c(C(=NCC1=O)c1ccccc1)cc(Br)cc2)C

c1cccc(c1)N(CCO)CC(Nc1ccc(Cl)c(c1)S(=O)(=O)N1CCOCC1)=O

c12ccc([N+](C)(C)C)cc2c2C[C@@]3(O)C4N(CC[C@@]53[C@H](c2[nH]1)Oc1c(ccc(c51)C4)O)CC1CC1

c1c(c2c([n+](Cc3ccc(C(F)(F)F)cc3)c1)cc(Cl)cc2)N1CCCC1

c1(ccccc1)-c1nnc(NCCN2CCOCC2)c(C#N)c1

C(CCCCCCCCCCCCCCCCCC)C1Oc2c(c(C)c(c(c2S1)C)O)C

C(C1CC1)CCC(=O)NC[C@H]1CCN(C1)CC(F)F

O=C(O)c1c(cccc1)-n1c(c(C)c(C)c1C)C

[C@]12([C@@H]([C@H](C)CCCC(C)C)CC[C@H]1[C@H]1[C@@H]([C@@]3(C(CC1)[C@@H]([C@@H](CC3)O)Cc1ccc(Br)cc1)C)CC2)C

N(c1ccc(cc1)C(F)(F)F)c1cc(C(F)(F)F)nc2n1ncn2

C1=CC2C(C1C1C2C(N(C1=O)c1cc(C(C)=O)ccc1OCC)=O)=C(C)C

c1(CCNC(=NCCCOC)S)ccc(cc1)F

C1[C@H](c2ccccc2OC)CC2(CO1)[C@@H](N(CCO2)Cc1n[nH]c(n1)O)c1ccc(F)cc1

c1c(/C=C2\Cc3ccc(cc3C2=O)N)cc(Br)c(O)c1Br

c1(c(=O)[nH]c(cc1-c1ccc(cc1)OCC)-c1ccc2c(c1)OCO2)C#N

O(c1ccc2nc(n(c(=O)c2n1)C[C@@H]1CN(CCC1)C(C)C)C)c1ccc(cc1)F

c12CC3CCC(c2c2ccccc2[nH]1)N3CCCC(=O)c1ccccc1

c1nc(CN2CCC(C2)N(Cc2noc(CC)n2)C(=O)C)cnc1C

c1ccccc1CC1(NC(N(CC(=O)NC(C)C23CC4CC(CC(C4)C3)C2)C1=O)=O)Cc1ccccc1

c12[C@H]3N(C)CCc2c(OC)c2OCOc2c1-c1cc(OC)c(cc1C3)OC

c1cc2ccc(cc2cc1)NS(c1ccc(NCc2c(O)c(ccc2)OC)cc1)(=O)=O

c1cccc(c1)CCC(=O)Nc1ccnn1C1CCN(CC1)Cc1c(n(nc1)C)C

n1c(noc1CN(C)C(c1cccc(c1)S(=O)(=O)N1CCNCC1)=O)C

O(C(=O)c1ccccc1)N(c1ccc(C(c2ccccc2)=O)cc1)C(=O)c1ccc(c(c1)OC)OC

C1C(C1)COc1c(CN[C@@H]2CN(CCC2)c2[nH]c3ccc(Cl)nc3n2)cc(cc1Cl)Cl

N1(S(c2ccc(cc2)NC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)(=O)=O)CCN(CC1)C

C(c1ccccc1)[C@@H](C(=O)N[C@@H](CCC(N)=O)C(=O)OCCCC=C)NC([C@@H](NC(=O)/C=C/c1ccccc1)[C@@H](C)O)=O

O=C1c2c3c(ccc2OCC1c1ccccc1)cccc3

C1(c2n(C)ccn2)CCNC1

O(S(=O)(N)=O)c1ccc2cc(-c3ccc(cc3)OS(N)(=O)=O)n(CCCCCCCCCC)c2c1

[O-][Cl+3]([O-])([O-])[O-].c1cc(ccc1)-c1[n+](c(cc(-c2ccccc2)c1)C)CCc1ccccc1

c1(n(-c2ccc(cc2)OC)nnn1)C(N1CCN(CC1)C/C=C/c1ccccc1)CC

N1(CCc2ccccc2C1c1ccccc1)C(NCCOC)=O

O=C(Nc1ccc(NC(=N)c2ncccc2)cc1F)c1ccc(c(F)c1)NC(c1ncccc1)=N

C1[C@@H]2N(C[C@H]1N(C2)c1nc(nc(c1)-c1cnc(N)nc1)N1CC[C@@](C)(C1)F)CC(F)F

c1(c(ccc2c1oc(cc2C(F)(F)F)=O)OCCCCCCCCCCCC)C

Fc1cccc(NC(CN(C(C2CC(N(Cc3ccccc3)C2)=O)=O)C)=O)c1

c1(c(c2ccc(OCCOc3c(S(=O)(=O)c4ccccc4)[n+](on3)[O-])cc2oc1=O)C)C(C)C

C1CN(c2c(c(ccc2)Cl)OC)CCN1CCCCNC(=O)c1c2CCc3ccc(cc3)CCc(c1)cc2

c1(cc(ccc1Cl)NC(=O)c1ccncc1)[N+]([O-])=O

C([C@H]1CC[C@H](c2ccc(C3Nc4c(ncnc4OC3(C)C)N)cc2)CC1)C(=O)O

c1c(c(F)ccc1OCC(=O)Nc1ccc(C(F)(F)F)cc1)F

c12ccc(cc2Sc2cc(O)ccc2N1C(C)=O)[N+]([O-])=O

C(Nc1c(N2CCCC2)cccc1)(=O)c1cnccc1

C(c1ccc(s1)-c1cc(ccc1)F)(=O)N(C)Cc1cccc(c1)O

N(C(=O)c1noc(c1[N+]([O-])=O)C)c1cc(ccc1OC)Cl

C[C@H]1[C@](CN(C1=O)c1c(cccc1C)C)(C(C)C)C(Nc1cc(cc(NC(C)C)c1)C(F)(F)F)=O

c1c(cc(CNC(C(F)(F)F)=O)c(F)c1)-c1nc2c(c(nc(n2)N2[C@@H](C)COCC2)N2[C@H](COCC2)C)cc1

C(C)(C)(C)[C@H](NC([C@H](C(C)(C)C)NC([C@@H]1N(C(C)C)CC1)=O)=O)C(N1C[C@]2(C3(C2(C)C)CCC3)C[C@H]1C(N[C@@]1(C(NS(=O)(N2CCCC2)=O)=O)[C@H](C=C)C1)=O)=O

NC(=N)NCCC[C@H](NC([C@H](CCCCN)NC(=O)[C@@H](NC([C@H](C(C)C)NC(=O)[C@@H](NC([C@H](CC(C)C)NC([C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@@H](N)C)CCCCN)CC(C)C)=O)=O)CCCCN)=O)CC(C)C)=O)C(N[C@@H](Cc1ccccc1)C(=O)N)=O

c1ccc2c(c1NC(C(=O)Nc1cccc3c1nccc3NC(CCCN(CC)CC)C)=O)nccc2NC(CCCN(CC)CC)C

c1c(C[C@H]2C(N[C@H](C(N[C@H](C(=O)NCC(O)=O)CO)=O)CSSC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(CNC([C@@H](NC(=O)CN3CCN(CCN(CCN(CC3)CC(=O)O)CC(=O)O)CC(O)=O)C)=O)=O)CCCC)C(N[C@@H](Cc3ccccc3)C(N[C@H](C(N[C@H](Cc3c[nH]c4ccccc34)C(N[C@@H](CCCCN)C(N[C@@H]([C@H](O)C)C(N2)=O)=O)=O)=O)Cc2ccccc2)=O)=O)=O)cccc1

c1c(cn(n1)Cc1ccccc1)C(NCCc1ccc2c(c1)OCO2)=O

n1([C@@H]2O[C@H](COP(O)(O)=O)[C@@H](O)[C@H]2Cl)c(=O)[nH]c(=O)c(C)c1

C(C)(C)(c1ccc(C#Cc2ccc(-n3c(nc4ccccc4c3=O)/C=C/c3ccc(o3)[N+](=O)[O-])c(c2)C)cc1)C

c1c2N(C(=O)C3(CCN(CC4CC4)CC3)Nc2ccc1)CC(C)(C)C

n1c2CCCCCn2nc1CNc1c(ccc(c1)C)C

c1(C)cc([Se]C(c2c(F)cc(cc2)F)Cn2ccnc2)cc(C)c1

c1(=O)c2cc(ccc2ncn1CCN1CCCCC1)NC(=O)Nc1cc(C(=O)C)ccc1

c12c(c3c(cccc3)oc1=O)n(nc2)CC(NC(C(=O)OC)CCSC)=O

C1CCCC(C1)[C@@H](N1Cc2c(ccc(Oc3ccccc3)c2)N=C1N)CCC(=O)N(C1CCCCC1)C(c1nc(sc1)C)C

c1(cc(ccc1C(C)C)C)OCCNC(c1c(cccc1)O)=O

C1C(n2nnc(C(C)O)c2)CCN(C(C2(c3ccc(C)cc3)CC2)=O)C1

C(=O)(CN1CCN(C)CC1)Nc1c2Cc3c([nH]nc3-c2ccc1)-c1csc(C#CCOc2ccccc2)c1

C1(=O)CCCC(N2CCCC2)=C1

s1c2ncnc(N3CCN(CC3)S(=O)(=O)c3ccc(cc3)C)c2cc1

C1(C)N(CCc2cc(c(OC)cc12)OC)S(=O)(c1cc(c(nc1)Cl)Cl)=O

[C@H]12c3cc(ccc3O[C@@](N(c3c(OC)cc(OC)cc3)C(=O)N2)(C)C1)Cl

c1(ccc2c(c1)c(no2)N)-n1c2c(c(n1)C)ncn(-c1ccc(-c3ccccc3CN3CC[C@H](O)C3)cc1)c2=O

c1cc(cnc1C(/C=C/c1c(F)cccc1F)=O)N1CC=CC1

C(c1c(cccc1)NC(=O)c1nc2CCN(C)Cc2s1)C(Nc1ncc(cc1)Cl)=O

O=Cc1cc(cc(c1O)-c1cc(c(O)cc1)CC=C)CC=C

C(NCCC[C@@H](C(=O)O)N/C(=C1/C([C@]2(C(Oc3c(c(O)c(c(c32)O)C)C(C)=O)=CC1=O)C)=O)C)(N)=N

Cc1onc(NC(CN2CC(C)CCC2)=O)c1

c1ccc(/N=C(/N=c2\snc(C)n2Cc2ccc(cc2)F)c2ccccc2)cc1

c1(ccccc1)C(OC[C@@H]1[C@@](C)([C@@](F)([C@@H](O1)n1c2c(c(NCc3ccco3)ncn2)nc1)C)OC(=O)C)=O

c1(cc(ccc1C)C(=O)N1CCN(c2cccc(c2)C(F)(F)F)CC1)C

c1c(ccc(S(=O)(N2CCC(CC2)C(NCC)=O)=O)c1)OC

c12c(cc(n1CC(F)(F)F)C(=O)N1CCOCC1)cc(cc2)OC1CCN(C2CCC2)CC1

C1CCCC(C[C@H](NC([C@H](CC(=O)NO)CCCc2ccc(cc2)Cl)=O)C(=O)NCCc2ccccc2)C1

c1cn2c(C(OC(C)=O)=C(c3ccccc3)[S+](c3ccccc3-2)[O-])c1

c1c([nH]c(c1)-c1cnc2c(n1)C(C)(C)CCC2(C)C)-c1ccc(cc1)C(=O)O

C1(N(CCOC1)Cc1nc(sc1)C)c1c(cn[nH]1)C

c1cc(c2c(cc(C)cc2)c1)C

c1(/C=N/Nc2nc3c([nH]2)cccc3)c2c([nH]c1)cccc2

CN(C)c1ncc(-c2c(noc2C)-c2cc(OC)c(c(OC)c2)OC)cc1

N(C(c1cn2c(nc1)ncc2)=O)Cc1ccc(cc1)S(=O)(c1cccc(c1)C(F)(F)F)=O

c1(C[C@H]2NC([C@@H]3CCCN3C(=O)[C@H](N(C(=O)[C@@H]3CCC=NN3C(=O)[C@@H]3N(C([C@H]([C@H](C)CC)NC2=O)=O)N=CCC3)C)Cc2ccccc2)=O)ccccc1