smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CCCCCC[C@H](N)c1ccc(C)o1 ZINC000072209805 343563678 /nfs/dbraw/zinc/56/36/78/343563678.db2.gz XBMPQXNXICZHPT-NSHDSACASA-N 0 3 195.306 3.558 40 0 AHABHN CCCCCC[C@@H](N)c1ccc(C)o1 ZINC000072209806 343563668 /nfs/dbraw/zinc/56/36/68/343563668.db2.gz XBMPQXNXICZHPT-LLVKDONJSA-N 0 3 195.306 3.558 40 0 AHABHN