smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name [O-]c1ccc2ccccc2c1CNc1ccc(Cl)cc1 ZINC000001679822 567937309 /nfs/dbraw/zinc/93/73/09/567937309.db2.gz CJSKBHKIZJSZAP-UHFFFAOYSA-N -1 3 283.758 4.811 40 10 CJCBHM Cc1cccc(C)c1NCc1c([O-])ccc2ccccc21 ZINC000005589836 170116724 /nfs/dbraw/zinc/11/67/24/170116724.db2.gz WTHVTPMNJBBBBW-UHFFFAOYSA-N -1 3 277.367 4.774 40 10 CJCBHM Cc1ccc(Cl)cc1NCc1cc(Cl)ccc1[O-] ZINC000021517957 171314170 /nfs/dbraw/zinc/31/41/70/171314170.db2.gz ZCZWBKRRKORFHY-UHFFFAOYSA-N -1 3 282.170 4.620 40 10 CJCBHM O=C1C=CC(=NNc2ccc([O-])c(Cl)c2)C=C1Cl ZINC000104251082 567916519 /nfs/dbraw/zinc/91/65/19/567916519.db2.gz WTIAICHPBWPDQK-NXVVXOECSA-N -1 3 283.114 4.820 40 10 CJCBHM