smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name COc1ccc2c(c1)CCCC(=[NH+]CCC[NH2+]CCCC[NH2+]CCCN)N2 ZINC000064454327 205190376 /nfs/dbraw/zinc/19/03/76/205190376.db2.gz FVWAHWHPKHYQSE-UHFFFAOYSA-N 3 3 375.561 2.540 1 30 GFEFHP