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]1CC(=O)C=C1[O-] 14439077 573679952 /nfs/dbraw/zinc/67/99/52/573679952.db2.gz XVMHOOYMJFUEQW-SECBINFHSA-N -1 3 182.263 2.505 1 0 endogenous,in-man AFAFHM CCCCCC[C@H]1CC(=O)C=C1[O-] 14439079 573682704 /nfs/dbraw/zinc/68/27/04/573682704.db2.gz XVMHOOYMJFUEQW-VIFPVBQESA-N -1 3 182.263 2.505 1 0 endogenous,in-man AFAFHM