clean_smiles
stringlengths 18
103
| id
stringlengths 14
14
| value
float64 -53.9
401
⌀ | scaffold
stringlengths 0
100
|
|---|---|---|---|
CCc1cc(C(=O)NCC2CCN(C(=O)c3[nH]c(C)cc3C)CC2C)on1
|
CP002142038979
| -27.34
|
O=C(NCC1CCN(C(=O)c2ccc[nH]2)CC1)c1ccno1
|
Cn1cccc1C(=O)N1CCC(F)(CNC(=O)c2cc(C(C)(C)C)no2)CC1
|
CP000742967120
| -25.12
|
O=C(NCC1CCN(C(=O)c2ccc[nH]2)CC1)c1ccno1
|
Cc1cnoc1C(=O)NCC1CCN(C(=O)c2cccn2C)CC1C
|
CP002428072895
| -25.08
|
O=C(NCC1CCN(C(=O)c2ccc[nH]2)CC1)c1ccno1
|
Cc1ccc(C(=O)N2CCC(C(C)(C)NC(=O)c3oncc3C)CC2)[nH]1
|
CP002638456116
| -24.54
|
O=C(NCC1CCN(C(=O)c2ccc[nH]2)CC1)c1ccno1
|
Cc1cc(C(=O)NCC2CCN(C(=O)c3cc(C#N)c[nH]3)CC2)on1
|
CP003266577684
| -23.92
|
O=C(NCC1CCN(C(=O)c2ccc[nH]2)CC1)c1ccno1
|
CCc1ccc(C(=O)N2CCC(CN(C)C(=O)c3cc(C(C)C)no3)CC2)[nH]1
|
CP001137276465
| -23.15
|
O=C(NCC1CCN(C(=O)c2ccc[nH]2)CC1)c1ccno1
|
CCc1cc(C(=O)NCC2(C)CCN(C(=O)c3cc(C(N)=O)c[nH]3)CC2)on1
|
CP000704053395
| -22.65
|
O=C(NCC1CCN(C(=O)c2ccc[nH]2)CC1)c1ccno1
|
CCOc1cc(C(=O)N[C@@H](C)C2CCN(C(=O)c3cc(C)c(C)[nH]3)CC2)on1
|
CP000581528095
| -22.63
|
O=C(NCC1CCN(C(=O)c2ccc[nH]2)CC1)c1ccno1
|
COCc1cc(C(=O)NCC2CCN(C(=O)c3cc(C#N)c[nH]3)CC2)on1
|
CP001958426141
| -22.01
|
O=C(NCC1CCN(C(=O)c2ccc[nH]2)CC1)c1ccno1
|
CCc1cc(C(=O)NCC2CCN(C(=O)c3cc(CN(C)C)c[nH]3)CC2)on1
|
CP001012025354
| -19.19
|
O=C(NCC1CCN(C(=O)c2ccc[nH]2)CC1)c1ccno1
|
CCc1cc(N2CCCC3(CC(NC(=O)C4CC5(CCOCC5)C4)C3)C2)ncn1
|
CP000250224775
| -26.87
|
O=C(NC1CC2(CCCN(c3ccncn3)C2)C1)C1CC2(CCOCC2)C1
|
CC1(C)CCC(C(=O)NNC(=O)C(=O)N2CCCC2)c2ccccc21
|
CP001150542669
| -23.18
|
O=C(NNC(=O)C1CCCc2ccccc21)C(=O)N1CCCC1
|
CC(C)N1CCC(N2CCCC(N(C)C(=O)Cc3ccoc3)CC2)C1=O
|
CP002344177325
| -22.32
|
O=C(Cc1ccoc1)NC1CCCN(C2CCNC2=O)CC1
|
CCC(=O)NC1CN(C(=O)CC2CNc3ccccc32)CC2(CC2)C1
|
CP003122299642
| -25.1
|
O=C(CC1CNc2ccccc21)N1CCCC2(CC2)C1
|
CC1CCN(C(=O)c2ccc3c(c2)N(C)CCO3)C1CNC(=O)C1(F)CCC1
|
CP000756487908
| null |
O=C(NCC1CCCN1C(=O)c1ccc2c(c1)NCCO2)C1CCC1
|
Cc1cc(C(=O)N2CC3(CC(NC(=O)C4CCC(=O)N4)c4nccn43)C2)ccn1
|
CP000042500962
| -19.13
|
O=C1CCC(C(=O)NC2CC3(CN(C(=O)c4ccncc4)C3)n3ccnc32)N1
|
O=C(c1ccc2ccoc2c1)N1CCC2(CCN(C(=O)c3ncccn3)CC2)C1
|
CP000229790850
| -24.53
|
O=C(c1ccc2ccoc2c1)N1CCC2(CCN(C(=O)c3ncccn3)CC2)C1
|
Cn1nc(C(=O)N2CCOC3(CCN(C(=O)Cc4nccs4)C3)C2)cc1F
|
CP002141632240
| -27.27
|
O=C(Cc1nccs1)N1CCC2(C1)CN(C(=O)c1cc[nH]n1)CCO2
|
CC1OCCC1C(=O)NCC(C)(NC(=O)CNC(=O)c1ccccc1)C1CC1
|
CP000975532319
| -19.54
|
O=C(CNC(=O)c1ccccc1)NC(CNC(=O)C1CCOC1)C1CC1
|
COc1nn(C)cc1C(=O)N(C)CCOCCNC(=O)C1CC2(CC(O)C2)C1
|
CP000771101855
| -16.31
|
O=C(NCCOCCNC(=O)C1CC2(CCC2)C1)c1cn[nH]c1
|
Cc1ncc(C(=O)N2CC3CCC2C2CN(C(=O)C4CC5(C4)CC5F)CC32)o1
|
CP000554773403
| null |
O=C(C1CC2(CC2)C1)N1CC2C3CCC(C2C1)N(C(=O)c1cnco1)C3
|
C[C@H](CNC(=O)COC1(C)CCC1)NC(=O)c1ccc2c(c1)CNC(=O)N2
|
CP002157088403
| -28.53
|
O=C(COC1CCC1)NCCNC(=O)c1ccc2c(c1)CNC(=O)N2
|
Cc1cnc(C(=O)N(C)CCCN(C)CC(=O)NCC2CC2)cc1C
|
CP002417906998
| -26.24
|
O=C(CNCCCNC(=O)c1ccccn1)NCC1CC1
|
CC1(C)CC(NC(=O)c2nnc3ccccc3n2)CN(C(=O)C2COC(=O)O2)C1
|
CP000270459659
| -25.67
|
O=C1OCC(C(=O)N2CCCC(NC(=O)c3nnc4ccccc4n3)C2)O1
|
Cc1cc(C)nc(-n2[nH]c(C(=O)NC3CCC(C(C)C)CC3)cc2=O)n1
|
CP000876964770
| 5.07
|
O=C(NC1CCCCC1)c1cc(=O)n(-c2ncccn2)[nH]1
|
O=C(c1cccc2c1CCC2)N1CCC2(CCCN2C(=O)c2ccoc2)C1
|
CP001657051829
| null |
O=C(c1cccc2c1CCC2)N1CCC2(CCCN2C(=O)c2ccoc2)C1
|
CC1CC(C)CC(C(=O)NC(C)C2(O)CN(c3ncnc4sccc34)C2)C1
|
CP001462497585
| -29.73
|
O=C(NCC1CN(c2ncnc3sccc23)C1)C1CCCCC1
|
COC1CCCC(C(=O)NCC2(OC)CN(c3ncnc4sccc34)C2)C1
|
CP001400656340
| -28.27
|
O=C(NCC1CN(c2ncnc3sccc23)C1)C1CCCCC1
|
CN(CC1CN(c2nc(Cl)nc3sccc23)C1)C(=O)C1CCCCC1
|
CP002466512104
| -27.3
|
O=C(NCC1CN(c2ncnc3sccc23)C1)C1CCCCC1
|
CC1(C)C[C@@H]1C(=O)NCC1CC2COCC2N1C(=O)c1cc2n(n1)CCCN2
|
CP000834096653
| -12.82
|
O=C(NCC1CC2COCC2N1C(=O)c1cc2n(n1)CCCN2)C1CC1
|
Cc1[nH]c2ccccc2c1C(=O)N1C[C@@H]2C[C@H]1CN2C(=O)C1CCS1(=O)=O
|
CP002259091397
| -18.55
|
O=C(c1c[nH]c2ccccc12)N1C[C@@H]2C[C@H]1CN2C(=O)C1CCS1(=O)=O
|
Cc1cc(CC(=O)N2C3CCC2CN(C(=O)CC2CN(C)C2)CC3)n(C)n1
|
CP002207037216
| null |
O=C(CC1CNC1)N1CCC2CCC(C1)N2C(=O)Cc1ccn[nH]1
|
Nc1cnccc1C(=O)N[C@H]1[C@@H]2CN(C(=O)c3ccn4ccnc4n3)C[C@@H]21
|
CP002451738286
| -27.01
|
O=C(N[C@H]1[C@@H]2CN(C(=O)c3ccn4ccnc4n3)C[C@@H]21)c1ccncc1
|
CC1CN(C(=O)c2coc(C(N)=O)c2)CCC1CNC(=O)[C@H]1CCC(=O)O1
|
CP001603119830
| -17.36
|
O=C1CC[C@H](C(=O)NCC2CCN(C(=O)c3ccoc3)CC2)O1
|
Cc1cocc1C(=O)N1CCC(CN(C)C(=O)[C@H]2CCC(=O)O2)CC1
|
CP003221640607
| -12.63
|
O=C1CC[C@H](C(=O)NCC2CCN(C(=O)c3ccoc3)CC2)O1
|
Fc1ccc(-c2nc(CN3CCN(C[C@H]4CCO4)CC3)cs2)cc1
|
CP001339981521
| -34.07
|
c1ccc(-c2nc(CN3CCN(C[C@H]4CCO4)CC3)cs2)cc1
|
Cc1cc(C(=O)N2CCC3(CC2)CN(C(=O)C2(C)COC2)C3)cs1
|
CP003406396285
| -21.92
|
O=C(c1ccsc1)N1CCC2(CC1)CN(C(=O)C1COC1)C2
|
CC1(C)C=C(C(=O)N2CCOCC(CNC(=O)c3ccc(C(N)=O)cc3)C2)C1
|
CP000750103410
| -27.46
|
O=C(NCC1COCCN(C(=O)C2=CCC2)C1)c1ccccc1
|
Cc1cc(C)c(C(=O)NCC2COCCN(C(=O)C3=CCC3)C2)c(C)c1
|
CP002603546448
| -26.58
|
O=C(NCC1COCCN(C(=O)C2=CCC2)C1)c1ccccc1
|
O=C(NCC1COCCN(C(=O)C2=CCC2)C1)c1cccc(F)c1F
|
CP003125221077
| -19.09
|
O=C(NCC1COCCN(C(=O)C2=CCC2)C1)c1ccccc1
|
Cc1c(C(=O)N2CC3CC2CN(C(=O)C24CCCCC2C4)C3)cnn1CCO
|
CP000588962194
| null |
O=C(c1cn[nH]c1)N1CC2CC1CN(C(=O)C13CCCCC1C3)C2
|
Cc1nc2ccnn2cc1C(=O)N1CCC(C)N(C(=O)c2scnc2C)CC1
|
CP000759432138
| -20.64
|
O=C(c1cnc2ccnn2c1)N1CCCN(C(=O)c2cncs2)CC1
|
CCOc1cc(NCC2CCN(C(=O)Cc3ccc4oc(=O)[nH]c4c3)C2)ncn1
|
CP000331977411
| -34.56
|
O=C(Cc1ccc2oc(=O)[nH]c2c1)N1CCC(CNc2ccncn2)C1
|
Cc1cc(NCC2CCN(C(=O)Cc3ccc4oc(=O)[nH]c4c3)C2)ncn1
|
CP001471850129
| -33.9
|
O=C(Cc1ccc2oc(=O)[nH]c2c1)N1CCC(CNc2ccncn2)C1
|
Cc1ncc(F)c(N(C)CC2CCN(C(=O)Cc3ccc4oc(=O)[nH]c4c3)C2)n1
|
CP000334235702
| -32.09
|
O=C(Cc1ccc2oc(=O)[nH]c2c1)N1CCC(CNc2ccncn2)C1
|
CN(C(=O)c1ncc2cc(Br)ccc2n1)C1CC(F)(F)C1
|
CP002285450668
| -24.85
|
O=C(NC1CCC1)c1ncc2ccccc2n1
|
O=C(NCCN(C(=O)c1cc2ccccn2c1)C1CC1)c1ccn2c1CCCC2
|
CP000348657295
| -27.34
|
O=C(NCCN(C(=O)c1cc2ccccn2c1)C1CC1)c1ccn2c1CCCC2
|
CCc1ocnc1C(=O)N1CCC(NC(=O)c2ccc(C(C)CC)[nH]c2=O)C1
|
CP001239796131
| -27.44
|
O=C(NC1CCN(C(=O)c2cocn2)C1)c1ccc[nH]c1=O
|
Cc1cc(C)c(C(=O)NC2CCN(C(=O)c3ncoc3C)C2)c(=O)[nH]1
|
CP003317739742
| -22.05
|
O=C(NC1CCN(C(=O)c2cocn2)C1)c1ccc[nH]c1=O
|
CCc1nc(C(=O)N2CCC(NC(=O)c3cccn(CCOC)c3=O)C2)co1
|
CP001239827324
| -21.01
|
O=C(NC1CCN(C(=O)c2cocn2)C1)c1ccc[nH]c1=O
|
CN(C(=O)c1cccn(C)c1=O)C1CCN(C(=O)c2cocn2)C1
|
CP003149565148
| -20.26
|
O=C(NC1CCN(C(=O)c2cocn2)C1)c1ccc[nH]c1=O
|
CCc1nc(C(=O)N2CCC(N(C)C(=O)c3cccn(C)c3=O)C2)co1
|
CP002727907303
| -17.83
|
O=C(NC1CCN(C(=O)c2cocn2)C1)c1ccc[nH]c1=O
|
CCc1nc(C(=O)N2CCC(NC(=O)c3cccn(O)c3=O)C2)co1
|
CP003317863829
| -17.67
|
O=C(NC1CCN(C(=O)c2cocn2)C1)c1ccc[nH]c1=O
|
Cc1nc(C(=O)N2CCC(C)(NC(=O)c3cc(C)c(C)[nH]c3=O)C2)co1
|
CP002720935599
| -14.08
|
O=C(NC1CCN(C(=O)c2cocn2)C1)c1ccc[nH]c1=O
|
CC(=CC(=O)N1CC2CCC1CN2C(=O)CCC(=O)N1CCOCC1)C(C)C
|
CP001071665034
| -20.94
|
O=C(CCC(=O)N1CC2CCC1CN2)N1CCOCC1
|
O=C(CCC(=O)N1CC2CCC1CN2CC=C(Cl)Cl)N1CCOCC1
|
CP002419748687
| -18.91
|
O=C(CCC(=O)N1CC2CCC1CN2)N1CCOCC1
|
CON=CC(=O)N1CC2CCC1CN2C(=O)CCC(=O)N1CCOCC1
|
CP002675311652
| -17.31
|
O=C(CCC(=O)N1CC2CCC1CN2)N1CCOCC1
|
CC(=O)NC(C)C(=O)N1CC2CCC1CN2C(=O)CCC(=O)N1CCOCC1
|
CP001071461231
| -16.24
|
O=C(CCC(=O)N1CC2CCC1CN2)N1CCOCC1
|
Cc1nn(C)cc1CCC(=O)N(C)CCN(C)C(=O)c1noc2c1COCC2
|
CP000692297513
| -25.19
|
O=C(CCc1cn[nH]c1)NCCNC(=O)c1noc2c1COCC2
|
CCCCC(CNC(=O)CCc1cn[nH]c1)NC(=O)c1noc2c1COCC2
|
CP000899047774
| -19.44
|
O=C(CCc1cn[nH]c1)NCCNC(=O)c1noc2c1COCC2
|
CCOC(=O)c1nn(CC(=O)NC(=O)NCc2ccco2)nc1C(F)(F)F
|
CP000002234349
| -14.32
|
O=C(Cn1nccn1)NC(=O)NCc1ccco1
|
CC1=C(C(=O)N2CCC(CNC(=O)C3COC(=O)O3)C2)CCCC1
|
CP003459638619
| -10.88
|
O=C1OCC(C(=O)NCC2CCN(C(=O)C3=CCCCC3)C2)O1
|
CN(CC1CCN(C(=O)C2=CCCC(C)(C)C2)C1)C(=O)C1COC(=O)O1
|
CP002948850399
| -10.26
|
O=C1OCC(C(=O)NCC2CCN(C(=O)C3=CCCCC3)C2)O1
|
Cc1ocnc1C(=O)NC(CNC(=O)C1CCc2cncn2C1)C1CCCCC1
|
CP000037496759
| -9.54
|
O=C(NC(CNC(=O)C1CCc2cncn2C1)C1CCCCC1)c1cocn1
|
CC1(CNC(=O)c2cncc3nc[nH]c23)CCN(C(=O)C2CC23CCC3)C1
|
CP001797841194
| -18.02
|
O=C(NCC1CCN(C(=O)C2CC23CCC3)C1)c1cncc2nc[nH]c12
|
Cc1ccc(C(=O)N(CCCNC(=O)C(C)N2CCCCCC2)C2CC2)nn1
|
CP000978818963
| -18.84
|
O=C(CN1CCCCCC1)NCCCN(C(=O)c1cccnn1)C1CC1
|
Cc1cc(Cl)ccc1C(=O)NC[C@]1(C)CCCN1C(=O)C(C)n1cccn1
|
CP001689381030
| -29.77
|
O=C(NCC1CCCN1C(=O)Cn1cccn1)c1ccccc1
|
CN(CC1CCCN1C(=O)C(F)n1cccn1)C(=O)c1cc(F)ccc1N
|
CP001977580053
| -29.09
|
O=C(NCC1CCCN1C(=O)Cn1cccn1)c1ccccc1
|
Cc1ccc(C(=O)N(C)CC2CCCN2C(=O)C(C)(C)n2cccn2)cc1O
|
CP000890029397
| -27.86
|
O=C(NCC1CCCN1C(=O)Cn1cccn1)c1ccccc1
|
Cc1ccn(CC(=O)N2CCCC2CNC(=O)c2c(N)cc(F)cc2Cl)n1
|
CP001789028506
| -27.58
|
O=C(NCC1CCCN1C(=O)Cn1cccn1)c1ccccc1
|
CN(CC1CCCN1C(=O)Cn1cc(Cl)cn1)C(=O)c1cc(N)cc(F)c1
|
CP001977241260
| -27.31
|
O=C(NCC1CCCN1C(=O)Cn1cccn1)c1ccccc1
|
Cc1cc(C(=O)N(C)CC2CCCN2C(=O)C(C)(C)n2cccn2)cc(N)c1O
|
CP000200103270
| -26.92
|
O=C(NCC1CCCN1C(=O)Cn1cccn1)c1ccccc1
|
Cc1ccc(C)c(C(=O)NC[C@]2(C)CCCN2C(=O)Cn2cccn2)c1
|
CP002516196199
| -26.07
|
O=C(NCC1CCCN1C(=O)Cn1cccn1)c1ccccc1
|
Cc1cccc(C)c1C(=O)NCC1CCCN1C(=O)Cn1ccc(C(F)F)n1
|
CP001065894734
| -25.37
|
O=C(NCC1CCCN1C(=O)Cn1cccn1)c1ccccc1
|
CN(CC1CCCN1C(=O)Cn1ccc(C(F)F)n1)C(=O)c1cccc(N)c1
|
CP000889715538
| -25.31
|
O=C(NCC1CCCN1C(=O)Cn1cccn1)c1ccccc1
|
CCC(C(=O)N1CC(C)(C)CC1CNC(=O)c1ccccc1OC)n1cccn1
|
CP000150605043
| -25.3
|
O=C(NCC1CCCN1C(=O)Cn1cccn1)c1ccccc1
|
Cc1ccc(C)c(C(=O)NCC2CC(C)(C)CN2C(=O)Cn2cccn2)c1
|
CP001753646463
| -25.23
|
O=C(NCC1CCCN1C(=O)Cn1cccn1)c1ccccc1
|
CC(C(=O)N1CC(C)(C)CC1CNC(=O)c1ccc(CF)cc1)n1cccn1
|
CP000606756875
| -25.16
|
O=C(NCC1CCCN1C(=O)Cn1cccn1)c1ccccc1
|
COc1c(C)cc(C(=O)NCC2(C)CCCN2C(=O)Cn2nccc2C)cc1C
|
CP000120489380
| -24.83
|
O=C(NCC1CCCN1C(=O)Cn1cccn1)c1ccccc1
|
Cc1ccc(C(=O)NCC2(C)CCCN2C(=O)Cn2nccc2C)cc1Cl
|
CP001652166814
| -24.54
|
O=C(NCC1CCCN1C(=O)Cn1cccn1)c1ccccc1
|
CN(CC1CCCN1C(=O)C(C)(C)n1cccn1)C(=O)c1ccc(F)cc1F
|
CP000890028947
| -24.43
|
O=C(NCC1CCCN1C(=O)Cn1cccn1)c1ccccc1
|
CN(CC1CCCN1C(=O)C(C)(C)n1cccn1)C(=O)c1cc(N)ccc1F
|
CP000890029374
| -24.32
|
O=C(NCC1CCCN1C(=O)Cn1cccn1)c1ccccc1
|
CCc1ccc(C(=O)NCC2CCCN2C(=O)C(F)n2cccn2)cc1Cl
|
CP002076015233
| -24.3
|
O=C(NCC1CCCN1C(=O)Cn1cccn1)c1ccccc1
|
Cc1cc(C(=O)NC[C@]2(C)CCCN2C(=O)Cn2nccc2N)ccc1Cl
|
CP001689380945
| -24.3
|
O=C(NCC1CCCN1C(=O)Cn1cccn1)c1ccccc1
|
Cc1cc(C(=O)NC[C@]2(C)CCCN2C(=O)Cn2cc(C#N)cn2)cc(C)c1F
|
CP000055756423
| -24.3
|
O=C(NCC1CCCN1C(=O)Cn1cccn1)c1ccccc1
|
Cc1ccc(C(=O)NCC2CCCN2C(=O)C(C)n2cc(Cl)cn2)c(N)c1
|
CP001789146786
| -23.96
|
O=C(NCC1CCCN1C(=O)Cn1cccn1)c1ccccc1
|
Cc1cc(C)c(C(=O)NC[C@@]2(C)CCCN2C(=O)Cn2cc(C)cn2)c(C)c1
|
CP000763774489
| -23.86
|
O=C(NCC1CCCN1C(=O)Cn1cccn1)c1ccccc1
|
Cc1ccc(Cl)c(C(=O)N(C)CC2CCCN2C(=O)Cn2cccn2)c1N
|
CP001976968880
| -23.7
|
O=C(NCC1CCCN1C(=O)Cn1cccn1)c1ccccc1
|
Cc1cnn(CC(=O)N2CCCC2CN(C)C(=O)c2cc(F)cc(F)c2)c1
|
CP001721198278
| -23.68
|
O=C(NCC1CCCN1C(=O)Cn1cccn1)c1ccccc1
|
Cc1cc(F)ccc1C(=O)NC[C@]1(C)CCCN1C(=O)Cn1cccn1
|
CP002516302677
| -23.56
|
O=C(NCC1CCCN1C(=O)Cn1cccn1)c1ccccc1
|
CCC(C(=O)N1CCC[C@]1(C)CNC(=O)c1cccc(F)c1C)n1cccn1
|
CP000764434001
| -23.52
|
O=C(NCC1CCCN1C(=O)Cn1cccn1)c1ccccc1
|
Cc1ccc(C)c(C(=O)NC[C@@]2(C)CCCN2C(=O)Cn2ccc(N)n2)c1
|
CP001765073730
| -22.77
|
O=C(NCC1CCCN1C(=O)Cn1cccn1)c1ccccc1
|
Cc1cccc(C)c1C(=O)NCC1CC(F)(F)CN1C(=O)Cn1ccc(N)n1
|
CP000590553237
| -22.59
|
O=C(NCC1CCCN1C(=O)Cn1cccn1)c1ccccc1
|
Cc1ccn(CC(=O)N2CCCC2CNC(=O)c2cc(C#N)ccc2O)n1
|
CP001789028526
| -22.38
|
O=C(NCC1CCCN1C(=O)Cn1cccn1)c1ccccc1
|
CCC(C(=O)N1CCCC1(C)CNC(=O)c1cc(C)cc(C)c1)n1cccn1
|
CP000672948503
| -22.32
|
O=C(NCC1CCCN1C(=O)Cn1cccn1)c1ccccc1
|
Cc1c(F)ccc(C(=O)N(C)CC2CCCN2C(=O)Cn2cccn2)c1N
|
CP001976968849
| -22.21
|
O=C(NCC1CCCN1C(=O)Cn1cccn1)c1ccccc1
|
CC(C)(C)c1cc(N)n(CC(=O)N2CCCC2CNC(=O)c2ccccc2O)n1
|
CP000345206409
| -21.4
|
O=C(NCC1CCCN1C(=O)Cn1cccn1)c1ccccc1
|
Cc1ccnn1CC(=O)N1CCCC1CNC(=O)c1ccccc1C(F)F
|
CP002076058272
| -21.3
|
O=C(NCC1CCCN1C(=O)Cn1cccn1)c1ccccc1
|
Cc1cnn(C(C)C(=O)N2CCCC2CNC(=O)c2cc(F)ccc2N)c1
|
CP001789305693
| -21.28
|
O=C(NCC1CCCN1C(=O)Cn1cccn1)c1ccccc1
|
Cc1cc(Cl)cc(C(=O)NC[C@@]2(C)CCCN2C(=O)C(F)n2cccn2)c1
|
CP001765491290
| -21.19
|
O=C(NCC1CCCN1C(=O)Cn1cccn1)c1ccccc1
|
End of preview. Expand
in Data Studio
README.md exists but content is empty.
- Downloads last month
- 11