smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
[O-]c1ccc(-c2c(Cl)c(Cl)cc(Cl)c2Cl)cc1Cl	ZINC000002598135	560188342	/nfs/dbraw/zinc/18/83/42/560188342.db2.gz	VQCLALDVRKEBBH-UHFFFAOYSA-N	-1	1	342.436	6.326	10	0	in-vitro	EKAEMM
[O-]c1ccc(-c2cc(Cl)c(Cl)c(Cl)c2Cl)cc1Cl	ZINC000002598140	209871264	/nfs/dbraw/zinc/87/12/64/209871264.db2.gz	CGAILIYIKMFHPA-UHFFFAOYSA-N	-1	1	342.436	6.326	10	0	in-vitro	EKAEMM
[O-]c1c(Cl)cc(Cl)cc1-c1cc(-c2ccc(Cl)cc2)n[nH]1	ZINC000004335958	210174356	/nfs/dbraw/zinc/17/43/56/210174356.db2.gz	ZSMNFZDPNSUVRP-UHFFFAOYSA-N	-1	1	339.609	5.410	10	0		EKAEMM
[O-]c1ccc(-c2c(Cl)cc(Cl)c(Cl)c2Cl)cc1Cl	ZINC000004655099	210237939	/nfs/dbraw/zinc/23/79/39/210237939.db2.gz	QLPPOBFMEBKBOZ-UHFFFAOYSA-N	-1	1	342.436	6.326	10	0	in-vitro	EKAEMM
[O-]c1cc(Cl)c(Cl)c(Cl)c1-n1ccc(Cl)c1Cl	ZINC000005162984	560201133	/nfs/dbraw/zinc/20/11/33/560201133.db2.gz	VQUHAXJBUPCVDX-UHFFFAOYSA-N	-1	1	331.413	5.450	10	0	in-vitro	EKAEMM
[O-]c1ccc(CNc2ccc(Cl)c(C(F)(F)F)c2)cc1Cl	ZINC000076272378	202387215	/nfs/dbraw/zinc/38/72/15/202387215.db2.gz	UPTDCBNGMHJERF-UHFFFAOYSA-N	-1	1	336.140	5.330	10	0		EKAEMM
O=C(c1sc2ccccc2c1-c1ccc(O)cc1)c1ccc([O-])cc1	ZINC000077301935	564064471	/nfs/dbraw/zinc/06/44/71/564064471.db2.gz	YCHUQIIHHWWHLR-UHFFFAOYSA-N	-1	1	346.407	5.211	10	0	in-vitro	EKAEMM
[O-]c1ccc(CNc2ccc(Br)cc2Cl)cc1Cl	ZINC000104049845	219342102	/nfs/dbraw/zinc/34/21/02/219342102.db2.gz	PVJJZSABFARSBN-UHFFFAOYSA-N	-1	1	347.039	5.074	10	0		EKAEMM
[O-]c1cc(Br)ccc1-c1nc2cc(Cl)ccc2s1	ZINC000104165885	204099068	/nfs/dbraw/zinc/09/90/68/204099068.db2.gz	BQHBEYGMGFQFCZ-UHFFFAOYSA-N	-1	1	340.629	5.085	10	0		EKAEMM