smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COCCCOC1CCN(C(=O)c2ccc([N-]S(=O)(=O)c3cccs3)cc2[O-])CC1	ZINC001293846730	1066349413	/nfs/dbraw/zinc/34/94/13/1066349413.db2.gz	SBCFWSPTBVAHML-UHFFFAOYSA-N	-2	1	454.570	2.912	20	0		JFADML
O=C(c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-])N1CC(=O)N(Cc2ccccc2)C1	ZINC001295104863	1062932367	/nfs/dbraw/zinc/93/23/67/1062932367.db2.gz	ZWJUIRGMVAZCTP-UHFFFAOYSA-N	-2	1	457.533	2.697	20	0		JFADML
C[S@](=O)c1ccc(CNC(=O)c2ccc([N-]S(=O)(=O)c3cccs3)cc2[O-])cc1	ZINC001294450828	1061996763	/nfs/dbraw/zinc/99/67/63/1061996763.db2.gz	NHSRAEBFPAQJLY-NDEPHWFRSA-N	-2	1	450.563	2.922	20	0		JFADML
CN(C(=O)CNC(=O)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-])C1CCCCC1	ZINC001295055708	1062859191	/nfs/dbraw/zinc/85/91/91/1062859191.db2.gz	GBDUBXNBXVXTRS-UHFFFAOYSA-N	-2	1	451.570	2.775	20	0		JFADML
Cc1cc(C(=O)N2CCC(N(CC3CC3)C(=O)OC(C)(C)C)CC2)[n-]c2nc(=O)[n-]c(=O)c1-2	ZINC001294291892	1061776731	/nfs/dbraw/zinc/77/67/31/1061776731.db2.gz	MWPDYUNKYUVCTF-UHFFFAOYSA-N	-2	1	457.531	2.996	20	0		JFADML
C[C@H]1CCCN(C(=O)CCNC(=O)c2ccc([N-]S(=O)(=O)c3cccs3)cc2[O-])C1	ZINC001264011991	1059504606	/nfs/dbraw/zinc/50/46/06/1059504606.db2.gz	DGSLZFZOEBWZHK-AWEZNQCLSA-N	-2	1	451.570	2.633	20	0		JFADML
C[C@@H]1CCCN(C(=O)CCNC(=O)c2ccc([N-]S(=O)(=O)c3cccs3)cc2[O-])C1	ZINC001264011992	1059505365	/nfs/dbraw/zinc/50/53/65/1059505365.db2.gz	DGSLZFZOEBWZHK-CQSZACIVSA-N	-2	1	451.570	2.633	20	0		JFADML
C[S@@](=O)c1ccc(CNC(=O)c2ccc([N-]S(=O)(=O)c3cccs3)cc2[O-])cc1	ZINC001294450827	1061996927	/nfs/dbraw/zinc/99/69/27/1061996927.db2.gz	NHSRAEBFPAQJLY-MUUNZHRXSA-N	-2	1	450.563	2.922	20	0		JFADML
CNC(=O)c1ccc(NC(=O)c2cc(S(=O)(=O)[N-]c3ccccc3OC)ccc2[O-])cc1	ZINC001290051435	1061769100	/nfs/dbraw/zinc/76/91/00/1061769100.db2.gz	VGIAQBDGVNOEJT-UHFFFAOYSA-N	-2	1	455.492	2.814	20	0		JFADML