1e6 drug-like molecules generated by lacan — approx. 1,000,000 rows, last changed
1 month
ago
| Row ID |
smiles |
idn |
|
1
|
CC(C)CCC1CCC(CCCO)CC1
|
ZRKJEVSWBMZXPL
|
|
2
|
Cc1ccc(S(N)(=O)=O)cc1CCCN(C)C
|
PJCHVYLLOCNIMR
|
|
3
|
CC(C)(C)Cc1cc(S(C)(=O)=O)c2ncn(-c3cnccn3)c2c1
|
RSOIQJINNUZINP
|
|
4
|
CS(=O)(=O)CCc1nc2ccccc2s1
|
UIJPVYOESDHXNV
|
|
5
|
CCN(CC1CCN(C)CC1)C(=O)c1ccccc1
|
ACGXCBGARJPUDB
|
| [999995 more rows] |
... |
... |