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(Cn1cc[nH+]c1)NNC(=O)c1cccc(-c2nn[nH]n2)c1 ZINC000823123262 946324543 /nfs/dbraw/zinc/32/45/43/946324543.db2.gz VFSVHCBBBBIXFT-UHFFFAOYSA-N 1 2 312.293 -0.476 20 50 DBGDLO O=C(Cn1cc[nH+]c1)NNC(=O)c1ccc(-c2nn[nH]n2)cc1 ZINC000823123201 946323128 /nfs/dbraw/zinc/32/31/28/946323128.db2.gz RRQLYTUMTNGHLJ-UHFFFAOYSA-N 1 2 312.293 -0.476 20 50 DBGDLO