smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1cc(C)c(S(=O)(=O)[N-]c2ccc([O-])c3ccccc23)c(C)c1	ZINC000000189696	563255957	/nfs/dbraw/zinc/25/59/57/563255957.db2.gz	MECMFNMYRLUUAD-UHFFFAOYSA-N	-2	3	341.432	4.271	50	10		EICAHL
O=S(=O)([N-]c1ccc([O-])c2ccccc12)c1cccc2ccccc21	ZINC000000575946	563350811	/nfs/dbraw/zinc/35/08/11/563350811.db2.gz	JLCBNJAVTYPOHV-UHFFFAOYSA-N	-2	3	349.411	4.499	50	10		EICAHL
Cc1c(Cl)c([O-])c(C(C)C)cc1[N-]S(=O)(=O)c1ccccc1	ZINC000000065416	209397104	/nfs/dbraw/zinc/39/71/04/209397104.db2.gz	MLAWOIICTZPZQT-UHFFFAOYSA-N	-2	3	339.844	4.278	50	10		EICAHL
Cc1cc([N-]S(=O)(=O)c2ccccc2)c(C(C)C)c(Cl)c1[O-]	ZINC000000065431	209396916	/nfs/dbraw/zinc/39/69/16/209396916.db2.gz	FPMUWLLQWSYUSS-UHFFFAOYSA-N	-2	3	339.844	4.278	50	10		EICAHL
CC(C)c1ccc(S(=O)(=O)[N-]c2ccc([O-])c3ccccc23)cc1	ZINC000000073775	258047531	/nfs/dbraw/zinc/04/75/31/258047531.db2.gz	ZNMJBSHFACRGMV-UHFFFAOYSA-N	-2	3	341.432	4.470	50	10		EICAHL
O=S(=O)([N-]c1ccc([O-])c2ccccc12)c1ccc2ccccc2c1	ZINC000000048539	209389532	/nfs/dbraw/zinc/38/95/32/209389532.db2.gz	KLZBAALATNLLOK-UHFFFAOYSA-N	-2	3	349.411	4.499	50	10		EICAHL
Cc1ccc(S(=O)(=O)[N-]c2cc(C)c([O-])c(Cl)c2Cl)cc1	ZINC000000036974	563968389	/nfs/dbraw/zinc/96/83/89/563968389.db2.gz	KMWCRBMMRDSSJP-UHFFFAOYSA-N	-2	3	346.235	4.117	50	10		EICAHL
CC(C)(C)c1ccc(S(=O)(=O)[N-]c2ccc([O-])c(Cl)c2)cc1	ZINC000000207207	563260111	/nfs/dbraw/zinc/26/01/11/563260111.db2.gz	LBQQJRMADSRJCJ-UHFFFAOYSA-N	-2	3	339.844	4.144	50	10		EICAHL
Cc1cc(C)c(S(=O)(=O)[N-]c2ccc([O-])c3ccccc23)cc1C	ZINC000004660869	210240210	/nfs/dbraw/zinc/24/02/10/210240210.db2.gz	LSXVBXDJYQKTSO-UHFFFAOYSA-N	-2	3	341.432	4.271	50	10		EICAHL
Cc1ccc(S(=O)(=O)[N-]c2cc(Cl)c([O-])c(Cl)c2C)cc1	ZINC000000084030	563219726	/nfs/dbraw/zinc/21/97/26/563219726.db2.gz	UXUAKVUHRMQMTR-UHFFFAOYSA-N	-2	3	346.235	4.117	50	10		EICAHL
Cc1ccc(S(=O)(=O)[N-]c2cc(Cl)c([O-])c3ccccc23)cc1	ZINC000000357263	563291580	/nfs/dbraw/zinc/29/15/80/563291580.db2.gz	QXIAEQPEFYAFEE-UHFFFAOYSA-N	-2	3	347.823	4.308	50	10		EICAHL