smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CCCCCCCCCCCC[C@@H](C)C[C@@H](C[NH3+])[NH+](C)C ZINC000228970271 570251993 /nfs/dbraw/zinc/25/19/93/570251993.db2.gz OGKFOZYEYIRZNK-MOPGFXCFSA-N 2 1 298.559 5.213 40 30 CKEBMP CCCCCCCCCCCC[C@H](C)C[C@@H](C[NH3+])[NH+](C)C ZINC000228970284 567906605 /nfs/dbraw/zinc/90/66/05/567906605.db2.gz OGKFOZYEYIRZNK-OALUTQOASA-N 2 1 298.559 5.213 40 30 CKEBMP CCCCCCCCCCCC[C@@H](C)C[C@H](C[NH3+])[NH+](C)C ZINC000228970296 567906525 /nfs/dbraw/zinc/90/65/25/567906525.db2.gz OGKFOZYEYIRZNK-RTBURBONSA-N 2 1 298.559 5.213 40 30 CKEBMP CCCCCCCCCCCC[C@H](C)C[C@H](C[NH3+])[NH+](C)C ZINC000228970309 567906679 /nfs/dbraw/zinc/90/66/79/567906679.db2.gz OGKFOZYEYIRZNK-RBUKOAKNSA-N 2 1 298.559 5.213 40 30 CKEBMP