smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name N[C@@H](CCCC[NH3+])C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCC[NH3+])C(=O)[O-] ZINC000011326236 556340714 /nfs/dbraw/zinc/34/07/14/556340714.db2.gz WINFHLHJTRGLCV-BZSNNMDCSA-N 1 3 437.541 -0.426 50 0 IBAAHO