smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CCC[C@@H](CC)CCCCCCC[NH3+] ZINC000145505884 167038358 /nfs/dbraw/zinc/03/83/58/167038358.db2.gz KFBNTNYCQVDLBK-CYBMUJFWSA-N 1 0 199.382 4.112 1 0 AIAFRO CCC[C@H](CC)CCCCCCC[NH3+] ZINC000145506066 167075420 /nfs/dbraw/zinc/07/54/20/167075420.db2.gz KFBNTNYCQVDLBK-ZDUSSCGKSA-N 1 0 199.382 4.112 1 0 AIAFRO