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@@H]1CC[C@H](CC)[PH+]1CC[P@H+]1[C@H](CC)CC[C@@H]1CC ZINC000096836823 185389080 /nfs/dbraw/zinc/38/90/80/185389080.db2.gz QOLRLVPABLMMKI-ZNXRSXASSA-N 2 0 314.434 6.652 10 0 DKAERP CC[C@@H]1CC[C@H](CC)[P@H+]1CC[PH+]1[C@@H](CC)CC[C@@H]1CC ZINC000096836824 185389198 /nfs/dbraw/zinc/38/91/98/185389198.db2.gz QOLRLVPABLMMKI-YLQJXANPSA-N 2 0 314.434 6.652 10 0 DKAERP