smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name c1c2ccc(cc3nc(cc4ccc(cc5ccc1[nH]5)[nH]4)CC3)n2 ZINC000005845716 560203530 /nfs/dbraw/zinc/20/35/30/560203530.db2.gz SURLGNKAQXKNSP-UHFFFAOYSA-N 0 1 312.376 4.378 1 5 in-vitro DIBFMN O=[N+]([O-])c1ccc(-c2nc3cc4ccc[nH]c4c(Cl)c3n2)cc1 ZINC000073224641 191295968 /nfs/dbraw/zinc/29/59/68/191295968.db2.gz XENAOWOBYWGOSI-UHFFFAOYSA-N 0 1 324.727 4.340 1 5 DIBFMN