smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name [O-]c1ccc(Br)cc1CNc1cc[nH+]cc1 ZINC000004290990 368540792 /nfs/dbraw/zinc/54/07/92/368540792.db2.gz DCZQBZGSOFURFW-UHFFFAOYSA-N 0 3 279.137 3.162 30 10 CGCCHN Oc1ccc(Br)cc1CNc1ccncc1 ZINC000004290990 368540802 /nfs/dbraw/zinc/54/08/02/368540802.db2.gz DCZQBZGSOFURFW-UHFFFAOYSA-N 0 3 279.137 3.162 30 10 CGCCHN