smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COc1ccc([C@@H]2CC(=O)Oc3cc([O-])c4c(=O)cc(-c5ccc([O-])cc5)oc4c32)cc1	ZINC000217842955	569453988	/nfs/dbraw/zinc/45/39/88/569453988.db2.gz	AHMRJQSSDKKCSQ-KRWDZBQOSA-N	-2	3	430.412	4.321	50	70	biogenic	IIIAHL
O=c1cc(-c2ccc([O-])cc2)oc2c1c([O-])cc1c2[C@H](c2ccc3c(c2)OCO3)CC(=O)O1	ZINC000217842527	569454003	/nfs/dbraw/zinc/45/40/03/569454003.db2.gz	ONLWJYIOTOFODR-HNNXBMFYSA-N	-2	3	444.395	4.041	50	70	biogenic	IIIAHL
COC(=O)C[C@H]1c2cccnc2Oc2cc([O-])c3c(=O)cc(-c4ccc([O-])cc4)oc3c21	ZINC000217996539	569455628	/nfs/dbraw/zinc/45/56/28/569455628.db2.gz	OGLYFVWRFOPZRW-HNNXBMFYSA-N	-2	3	431.400	4.067	50	70	biogenic	IIIAHL
COC(=O)C[C@@H]1c2cccnc2Oc2cc([O-])c3c(=O)cc(-c4ccc([O-])cc4)oc3c21	ZINC000217996455	569455634	/nfs/dbraw/zinc/45/56/34/569455634.db2.gz	OGLYFVWRFOPZRW-OAHLLOKOSA-N	-2	3	431.400	4.067	50	70	biogenic	IIIAHL
O=c1cc(-c2ccc([O-])cc2)oc2c1c([O-])cc1c2[C@@H](c2ccc3c(c2)OCO3)CC(=O)O1	ZINC000217842613	569454025	/nfs/dbraw/zinc/45/40/25/569454025.db2.gz	ONLWJYIOTOFODR-OAHLLOKOSA-N	-2	3	444.395	4.041	50	70	biogenic	IIIAHL
COc1ccc([C@H]2CC(=O)Oc3cc([O-])c4c(=O)cc(-c5ccc([O-])cc5)oc4c32)cc1	ZINC000217843023	569454042	/nfs/dbraw/zinc/45/40/42/569454042.db2.gz	AHMRJQSSDKKCSQ-QGZVFWFLSA-N	-2	3	430.412	4.321	50	70	biogenic	IIIAHL