smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name O=C1c2[nH]nc(-c3ccccc3)c2[C@@H](c2cccc([N+](=O)[O-])c2)N1c1ccccc1 ZINC000017207858 221381204 /nfs/dbraw/zinc/38/12/04/221381204.db2.gz ZMUJSQUPWBKHBQ-JOCHJYFZSA-N -1 2 396.406 4.735 50 5 GJBALM Cc1cc(C(=C(Cl)Cl)c2cc(C)c(O)c([N+](=O)[O-])c2)cc([N+](=O)[O-])c1[O-] ZINC000036046701 570520705 /nfs/dbraw/zinc/52/07/05/570520705.db2.gz OHHOLZWTBLIIGH-UHFFFAOYSA-N -1 2 399.186 4.726 50 5 GJBALM