smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name O=C([O-])COc1c(Cl)cc(C=C2C(=O)NC(=O)N(c3ccc(F)cc3)C2=O)cc1Cl ZINC000033321749 527614911 /nfs/dbraw/zinc/61/49/11/527614911.db2.gz QZCYEPSXFMAEHS-XGICHPGQSA-N -1 2 453.209 4.103 10 10 JICELM O=C([O-])c1ccc(COc2ccccc2C=C2C(=O)NC(=O)N(c3ccc(O)cc3)C2=O)cc1 ZINC000033456418 526369050 /nfs/dbraw/zinc/36/90/50/526369050.db2.gz QSKAFKUWAXSFRR-DEDYPNTBSA-N -1 2 458.426 4.176 10 10 JICELM