smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C[NH+](C)CCCNc1cc(/C=C/c2ccc([N+](=O)[O-])cc2)[nH+]c2ccccc12 ZINC000005460276 570440731 /nfs/dbraw/zinc/44/07/31/570440731.db2.gz RWUQBOXMJIIXOZ-DHZHZOJOSA-N 2 0 376.460 4.677 40 5 GJBBRP C[NH+](C)CCCNc1cc(/C=C\c2ccc([N+](=O)[O-])cc2)[nH+]c2ccccc12 ZINC000017129868 207085432 /nfs/dbraw/zinc/08/54/32/207085432.db2.gz RWUQBOXMJIIXOZ-FLIBITNWSA-N 2 0 376.460 4.677 40 5 GJBBRP