smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Cc1ccc(CN(C)C)cc1NC(=O)[C@H]1CCO[C@@H]1c1cnn(Cc2ccccc2)c1 ZINC000328606028 569418310 /nfs/dbraw/zinc/41/83/10/569418310.db2.gz QDWNXJUWXBZSPF-LADGPHEKSA-N 0 3 418.541 4.667 20 30 HJEDHN