smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name c1coc([C@H]2CCC[N@H+]2CCCN2CCCCC2)c1 ZINC000161137904 526570758 /nfs/dbraw/zinc/57/07/58/526570758.db2.gz PVKYPIHHYMMZIY-OAHLLOKOSA-N 1 3 262.397 3.293 10 70 CGIEHO c1coc([C@H]2CCC[N@@H+]2CCCN2CCCCC2)c1 ZINC000161137904 526570763 /nfs/dbraw/zinc/57/07/63/526570763.db2.gz PVKYPIHHYMMZIY-OAHLLOKOSA-N 1 3 262.397 3.293 10 70 CGIEHO c1coc([C@@H]2CCC[N@H+]2CCCN2CCCCC2)c1 ZINC000161137761 526569815 /nfs/dbraw/zinc/56/98/15/526569815.db2.gz PVKYPIHHYMMZIY-HNNXBMFYSA-N 1 3 262.397 3.293 10 70 CGIEHO c1coc([C@@H]2CCC[N@@H+]2CCCN2CCCCC2)c1 ZINC000161137761 526569819 /nfs/dbraw/zinc/56/98/19/526569819.db2.gz PVKYPIHHYMMZIY-HNNXBMFYSA-N 1 3 262.397 3.293 10 70 CGIEHO