smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CS(=O)(=O)[N-]c1ccccc1C(=O)Nc1ccccc1C(=O)c1ccccc1 ZINC000218396234 570333169 /nfs/dbraw/zinc/33/31/69/570333169.db2.gz WIHLWRTXLDOHPD-UHFFFAOYSA-N -1 0 394.452 3.541 40 70 GHIBRM