smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name COC(=O)c1sc2c(cnc3c2cccc3C(C)C)c1O ZINC000062719791 184250403 /nfs/dbraw/zinc/25/04/03/184250403.db2.gz JCJOKTJPDKVXOO-UHFFFAOYSA-N 0 2 301.367 4.065 40 10 DICBLN O=[N+]([O-])c1ccc(O)c(CNc2ccc(Cl)cc2Cl)c1 ZINC000255189522 568417089 /nfs/dbraw/zinc/41/70/89/568417089.db2.gz QJBCGHFGRSKIAS-UHFFFAOYSA-N 0 2 313.140 4.219 40 10 DICBLN COC(=O)c1sc(SCc2ccccc2)c(Cl)c1O ZINC000096510990 563486191 /nfs/dbraw/zinc/48/61/91/563486191.db2.gz XUCRVCFMGWWOBJ-UHFFFAOYSA-N 0 2 314.815 4.186 40 10 DICBLN