smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name O=C1[N-]C(=S)SC1=Cc1cc(Cl)cc([N+](=O)[O-])c1[O-] ZINC000034387683 304799088 /nfs/dbraw/zinc/79/90/88/304799088.db2.gz ARPSXTYRZVEFHB-FARCUNLSSA-N -2 1 316.747 3.283 40 5 DGBBML