Drug_ID
stringlengths 6
9
| Drug
stringlengths 4
325
| Y
float64 0
1
|
|---|---|---|
Drug 8544
|
CN1CCN(Cc2cc(-c3ccc4nc(O)oc4c3)co2)[C@@H](c2ccc(F)cc2)C1.Cl.O
| 1
|
Drug 8547
|
CCOC(=O)[C@]1(c2ccccc2)Oc2ccccc2[C@@H]1N
| 0
|
Drug 8548
|
Cl.O=C(N[C@H](c1ccccc1)[C@@H]1CN2CCC1CC2)c1c(Cl)ccc(C(F)(F)F)c1Cl
| 1
|
Drug 8549
|
O=C(Nc1ccc2[nH]ccc2c1)c1cc2cc(F)ccc2n1Cc1cccc(F)c1
| 1
|
Drug 8550
|
COc1ccc(C(=O)Nc2nc3ccccc3c(NCc3ccccc3)c2C#N)cc1
| 1
|
Drug 8551
|
CCOC(=O)O[C@H](C)OC(=O)c1ccc2c(c1)cc(C(=O)NC1CCN(C(C)C)CC1)n2Cc1cc(-c2ccc(Cl)s2)on1.Cl
| 1
|
Drug 8552
|
CCN(Cc1cccnc1)C(=O)c1cccc(Cl)c1[C@]1(C)C(=O)N(Cc2ccc(OC)cc2OC)c2ccc(Cl)cc21.Cl
| 0
|
Drug 8553
|
CCCOc1sc(C(=O)N2CCC(c3cc(CN)ccc3F)CC2)c(C)c1Br.Cl
| 1
|
Drug 8554
|
O=C([O-])c1ccc2c(c1)nc(C(=O)NC1CCN(C3CC3)CC1)n2Cc1cc(-c2ccc(Cl)s2)on1.[Na+]
| 0
|
Drug 8555
|
CC(=O)O.COCCOc1cc2cc(C(=O)NC3CCN(C(C)C)CC3)n(CC(=O)Nc3ccc(Cl)cn3)c2cn1
| 0
|
Drug 8556
|
CC(=O)NC1(c2cccc(F)c2)CCN(CC[C@@]2(c3ccc(Cl)c(Cl)c3)CN(c3ccccc3)C(=O)CO2)CC1.O=C(O)CCC(=O)O
| 1
|
Drug 8557
|
CCOC(=O)c1ccc([C@H]2CC[C@H](NC[C@H](O)COc3ccc(O)c(NS(C)(=O)=O)c3)CC2)cc1.Cl
| 1
|
Subsets and Splits
No community queries yet
The top public SQL queries from the community will appear here once available.