smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name O=S(=O)([N-]c1cccc(C(F)(F)F)c1)c1nc2nc(Cl)nc(Cl)c2s1 ZINC000015444298 556528511 /nfs/dbraw/zinc/52/85/11/556528511.db2.gz AQAISTHECAHUOS-UHFFFAOYSA-N -1 0 429.232 4.213 30 0 IIACRM COc1cc([N-]S(=O)(=O)c2ccc(C)cc2)c(C(=O)Cc2ccccc2)cc1OC ZINC000004244692 568939828 /nfs/dbraw/zinc/93/98/28/568939828.db2.gz ZKXWXWJOMGXWCR-UHFFFAOYSA-N -1 0 425.506 4.238 30 0 IIACRM