Compound Name

SMILES String

Clc1ccc(cc1)[C@H]1CN(CCN1C(=O)c1ccc(Br)cc1)C(=O)c1cnn2cc(Br)ccc12 |r|

CC(C)c1cc(Cl)c2cc([nH]c2c1F)C(O)=O

[H][C@]12C[C@@]3([H])[C@]4([H])CC[C@@]5([H])C[C@H](O)CC[C@]5(C)[C@@]4([H])[C@@H](O)C[C@]3(C)[C@@]1([H])[C@@](C)(O)[C@]1(C[C@H](C)C(C)(C)O1)O2 |r|

Cc1cc2CCC(Oc2cc1N1Cc2cn(C)c(=O)cc2NC1=O)c1ncccc1F

CN1C(=O)N(Cc2cn(Cc3ccccc3)c(=O)cc12)c1cc2OC(CCc2cc1C)c1ncccc1F

Fc1cccnc1C1CCc2ccc(cc2O1)N1Cc2cn(Cc3ccccc3)c(=O)cc2NC1=O

c1ccc(cc1)CN2C=C3CN(C(=O)NC3=CC2=O)c4cccc(c4)OCc5ccccc5

O=C1Nc2cc(=O)n(Cc3ccccc3)cc2CN1c1cccc(OCc2ccccn2)c1

O=C1Nc2cc(=O)n(Cc3ccccc3)cc2CN1c1cccc(OCc2cccnc2)c1

O=C1Nc2cc(=O)n(Cc3ccccc3)cc2CN1c1cccc(OCc2cncs2)c1

O=C1Nc2cc(=O)n(Cc3ccccc3)cc2CN1c1ccccc1OCc1ccccc1

CCCC1=NN2C(S1)=NC(=O)\C(=C/c1ccc(o1)-c1cccc(c1)C(O)=O)C2=N |c:8,t:3|

OC(=O)c1cccc(c1)-c1ccc(\C=C2/C(=O)N=C3SC(=NN3C2=N)C2CCCCC2)o1 |c:21,t:18|

Cc1cc2CCC(Oc2cc1N1Cc2cn(CC(F)(F)F)c(=O)cc2NC1=O)c1ncccc1F

Cc1cc2CCC(Oc2cc1N1Cc2cn(Cc3ccccc3)c(=O)cc2NC1=O)c1ncccc1F

CC(C)C[C@H]1C[C@@H](C)[C@@]2(N1C(=O)c1cn(Cc3ccccc3)cn1)C(=O)Nc1ccc(F)cc21 |r|

COC(=O)[C@@H]1C[C@H](CC(C)C)N(C(=O)c2ccccn2)[C@@]11C(=O)Nc2cccc(F)c12 |r|

COC(=O)[C@@H]1C[C@H](CC(C)C)N(C(=O)c2ccccn2)[C@@]11C(=O)Nc2ccc(F)cc12 |r|

COC(=O)[C@@H]1C[C@H](CC(C)C)N(C(=O)c2ccccn2)[C@@]11C(=O)Nc2cc(F)ccc12 |r|

COC(=O)[C@@H]1C[C@H](CC(C)C)N(C(=O)c2ccccn2)[C@@]11C(=O)Nc2c1cccc2F |r|

COC(=O)[C@@H]1C[C@H](CC(C)C)N(C(=O)c2ccccc2)[C@@]11C(=O)Nc2ccc(F)cc12 |r|

COC(=O)[C@@H]1C[C@H](CC(C)C)N(C(=O)c2ccncc2)[C@@]11C(=O)Nc2ccc(F)cc12 |r|

COC(=O)[C@@H]1C[C@H](CC(C)C)N(C(=O)c2ccn(C)n2)[C@@]11C(=O)Nc2ccc(F)cc12 |r|

COC(=O)[C@@H]1C[C@H](CC(C)C)N(C(=O)c2nccn2C)[C@@]11C(=O)Nc2ccc(F)cc12 |r|

COC(=O)[C@@H]1C[C@H](CC(C)C)N(C(=O)c2c[nH]cn2)[C@@]11C(=O)Nc2ccc(F)cc12 |r|

COC(=O)[C@@H]1C[C@H](CC(C)C)N(C(=O)c2cn(Cc3ccccc3)cn2)[C@@]11C(=O)Nc2ccc(F)cc12 |r|

CC(C)C[C@H]1C[C@@H](C)[C@@]2(N1C(=O)c1cn(C)cn1)C(=O)Nc1ccc(F)cc21 |r|

CC(C)C[C@@H]1C[C@H](C)[C@]2(N1C(=O)c1cn(C)cn1)C(=O)Nc1ccc(F)cc21 |r|

CC(C)C[C@@H]1C[C@H](C)[C@]2(N1C(=O)c1cn(Cc3ccccc3)cn1)C(=O)Nc1ccc(F)cc21 |r|

COC(=O)[C@@H]1C[C@H](CC(C)C)N(C(=O)c2ccccn2)[C@@]11C(=O)Nc2ccccc12 |r|

COC(=O)[C@H]1C[C@@H](CC(C)C)N(C(=O)c2ccccn2)[C@]11C(=O)Nc2ccccc12 |r|

CC(C)C[C@H]1C[C@@H](C(O)=O)[C@@]2(N1C(=O)c1ccccn1)C(=O)Nc1ccccc21

CC(C)C[C@H]1C[C@@H](C(N)=O)[C@@]2(N1C(=O)c1ccccn1)C(=O)Nc1ccccc21 |r|

CC(C)C[C@H]1C[C@@H](CF)[C@@]2(N1C(=O)c1ccccn1)C(=O)Nc1ccccc21 |r|

CC(C)C[C@H]1C[C@@H](CCl)[C@@]2(N1C(=O)c1ccccn1)C(=O)Nc1ccccc21 |r|

COC(=O)[C@@H]1C[C@H](CC(C)C)N(C(=O)c2ccccn2)[C@@]11C(=O)N(C)c2ccccc12 |r|

COC(=O)[C@@H]1C[C@H](CC(C)C)N(C(=O)Cc2ccccn2)[C@@]11C(=O)Nc2ccccc12 |r|

COC(=O)[C@@H]1C[C@H](C)N(C(=O)c2ccccn2)[C@@]11C(=O)Nc2ccccc12 |r|

CC(C)C[C@H]1C[C@@H](CO)[C@@]2(N1C(=O)c1ccccn1)C(=O)Nc1ccccc21 |r|

CC(C)C[C@H]1C[C@@H](C)[C@@]2(N1C(=O)c1ccccn1)C(=O)Nc1ccccc21 |r|

COC(=O)[C@@H]1C[C@H](Cc2ccccc2)N(C(=O)c2ccccn2)[C@@]11C(=O)Nc2ccccc12 |r|

COC(=O)[C@H]1C[C@H](CC(C)C)N(C(=O)c2ccccn2)[C@@]11C(=O)Nc2ccccc12 |r|

COC(=O)[C@@H]1C[C@H](CC(C)C)N(C(=O)c2ccccn2)[C@@]11C(=O)Nc2ccc(Cl)cc12 |r|

COC(=O)[C@@H]1C[C@H](CC(C)C)N(C(=O)c2cccnc2)[C@@]11C(=O)Nc2ccc(F)cc12 |r|

COC(=O)[C@@H]1C[C@H](CC(C)C)N(C(=O)c2cn(C)cn2)[C@@]11C(=O)Nc2ccc(F)cc12 |r|

Cc1c(cnn1-c1cccc(c1)C#N)C(=O)N1CCN([C@H](C1)c1ccc(Cl)cc1)C(=O)c1ccc(Br)cc1 |r|

FC(F)(F)c1cccc(c1)-c1cc(cn(-c2ccccc2)c1=O)C(=O)N1CCN([C@H](C1)c1ccc(Cl)cc1)C(=O)c1ccc(Br)cn1 |r|

Cn1cc(cc(-c2cccc(c2)C#N)c1=O)C(=O)N1CCN([C@H](C1)c1ccc(Cl)cc1)C(=O)c1ccc(Br)cn1 |r|

Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12

Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2c1cnn2C

CCNC(=O)C[C@@H]1N=C(c2ccc(Cl)cc2)c2cc(OC)ccc2-n2c(C)nnc12 |r,t:7|