smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CC(C)C[C@H]1CC(=O)Oc2cc([O-])c3c(=O)cc(-c4ccccc4)oc3c21 ZINC000217933546 206365181 /nfs/dbraw/zinc/36/51/81/206365181.db2.gz QGCQQEDHILTOEN-AWEZNQCLSA-N -1 1 364.397 4.604 50 70 FJIAMM CC(C)C[C@H]1CC(=O)Oc2cc(=O)c3c([O-])cc(-c4ccccc4)oc-3c21 ZINC000217933546 206365184 /nfs/dbraw/zinc/36/51/84/206365184.db2.gz QGCQQEDHILTOEN-AWEZNQCLSA-N -1 1 364.397 4.604 50 70 FJIAMM CC(C)C[C@@H]1CC(=O)Oc2cc([O-])c3c(=O)cc(-c4ccccc4)oc3c21 ZINC000217933460 571351721 /nfs/dbraw/zinc/35/17/21/571351721.db2.gz QGCQQEDHILTOEN-CQSZACIVSA-N -1 1 364.397 4.604 50 70 FJIAMM CC(C)C[C@@H]1CC(=O)Oc2cc(=O)c3c([O-])cc(-c4ccccc4)oc-3c21 ZINC000217933460 571351722 /nfs/dbraw/zinc/35/17/22/571351722.db2.gz QGCQQEDHILTOEN-CQSZACIVSA-N -1 1 364.397 4.604 50 70 FJIAMM