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-])c1cc(=O)c2cc3c(=O)cc(C(=O)[O-])[nH]c3c(F)c2[nH]1 ZINC000039221288 183015515 /nfs/dbraw/zinc/01/55/15/183015515.db2.gz AVXJYTICAOFLJO-UHFFFAOYSA-N -2 0 318.216 0.905 1 5 DCBFRL CC(=O)N[C@H](Cc1cc([N+](=O)[O-])cc([N+](=O)[O-])c1[O-])C(=O)[O-] ZINC000025989502 182428082 /nfs/dbraw/zinc/42/80/82/182428082.db2.gz YSJXWUCOJMNTRC-MRVPVSSYSA-N -2 0 313.222 0.340 1 5 DCBFRL