smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name O=C1c2cccc(O[C@@H]3O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)c2C(=O)c2c(O)cc(CO)cc21 ZINC000015060500 571729901 /nfs/dbraw/zinc/72/99/01/571729901.db2.gz KIZBWUUJNJEYCM-ZWGZVERISA-N -1 0 432.381 -1.161 1 10 endogenous,in-man IACFRM O=C1c2cccc(O[C@H]3O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)c2C(=O)c2c(O)cc(CO)cc21 ZINC000015060502 571730004 /nfs/dbraw/zinc/73/00/04/571730004.db2.gz KIZBWUUJNJEYCM-CFTTZIQCSA-N -1 0 432.381 -1.161 1 10 endogenous,in-man IACFRM O=C1c2cccc(O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)c2C(=O)c2c(O)cc(CO)cc21 ZINC000015060503 571729973 /nfs/dbraw/zinc/72/99/73/571729973.db2.gz KIZBWUUJNJEYCM-MJWXRJPWSA-N -1 0 432.381 -1.161 1 10 endogenous,in-man IACFRM