smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COC(=O)C[C@@H](c1ccc(C(=O)[O-])cc1)C1=C([O-])C(=O)C([C@H](CC(=O)OC)c2ccc(C(=O)[O-])cc2)C(=O)C1=O	ZINC000218089816	1059487856	/nfs/dbraw/zinc/48/78/56/1059487856.db2.gz	PMXZPAQTRXKSQB-HDICACEKSA-N	-3	2	552.488	2.853	50	30		KFEALL
COC(=O)C[C@H](c1ccc(C(=O)[O-])cc1)C1=C([O-])C(=O)C([C@@H](CC(=O)OC)c2ccc(C(=O)[O-])cc2)C(=O)C1=O	ZINC000218089816	1059487848	/nfs/dbraw/zinc/48/78/48/1059487848.db2.gz	PMXZPAQTRXKSQB-HDICACEKSA-N	-3	2	552.488	2.853	50	30		KFEALL
CC(=O)c1c2c(c(O)c(C)c1O)[C@]1(C)C(=CC(=O)C(C(C)=Nc3cc(-c4nnn(CCCC(=O)[O-])n4)ccc3O)C1=O)O2	ZINC000828512152	1059554883	/nfs/dbraw/zinc/55/48/83/1059554883.db2.gz	WLWWLZZEUXDCMS-BCMZQPROSA-N	-3	2	589.561	2.905	50	30		KFEALL