smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CCCCCCCCCCCCCCCC[NH2+]C[C@H](O)C[NH3+] ZINC000073329708 191305116 /nfs/dbraw/zinc/30/51/16/191305116.db2.gz GNSGPFUUHJVGPK-LJQANCHMSA-N 2 0 314.558 4.377 1 30 DIEFRP CCCCCCCCCCCCCCCC[NH2+]C[C@@H](O)C[NH3+] ZINC000073329711 191304407 /nfs/dbraw/zinc/30/44/07/191304407.db2.gz GNSGPFUUHJVGPK-IBGZPJMESA-N 2 0 314.558 4.377 1 30 DIEFRP