smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Cc1[nH][nH]c(=O)c1N=Nc1ccc(Br)c(Cl)c1 ZINC000018137410 182094302 /nfs/dbraw/zinc/09/43/02/182094302.db2.gz KVELEOAYXWGCEU-PFONDFGASA-N 0 2 315.558 4.255 1 10 DICFLN