smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COc1cc([S-])ccc1Cl	39215948	168239624	/nfs/dbraw/zinc/23/96/24/168239624.db2.gz	AXGCKAXNQUIPER-UHFFFAOYSA-N	-1	0	174.652	2.637	30	0		AFACRM
COc1ccc(SC)cc1[S-]	71792093	168256817	/nfs/dbraw/zinc/25/68/17/168256817.db2.gz	MWTBGEISMVEHJC-UHFFFAOYSA-N	-1	0	186.301	2.706	30	0		AFACRM
Cc1cc([S-])cc(Cl)c1	71792234	168778409	/nfs/dbraw/zinc/77/84/09/168778409.db2.gz	PEEYRKVXQAKUMR-UHFFFAOYSA-N	-1	0	158.653	2.937	30	0		AFACRM
Fc1ccc(F)c(Cl)c1[S-]	40571898	169083346	/nfs/dbraw/zinc/08/33/46/169083346.db2.gz	ANYGKIJRPXKKPQ-UHFFFAOYSA-N	-1	0	180.606	2.907	30	0		AFACRM
Fc1ccc(Cl)c([S-])c1F	40571878	169083491	/nfs/dbraw/zinc/08/34/91/169083491.db2.gz	VEHXKWMFVMPROG-UHFFFAOYSA-N	-1	0	180.606	2.907	30	0		AFACRM
Fc1cc(F)c([S-])c(Cl)c1	67794419	171062555	/nfs/dbraw/zinc/06/25/55/171062555.db2.gz	QYHYRJXJPRBUIP-UHFFFAOYSA-N	-1	0	180.606	2.907	30	0		AFACRM
C=Cc1ccc(Cl)cc1C(=O)[O-]	238644204	344817104	/nfs/dbraw/zinc/81/71/04/344817104.db2.gz	OQHFZIWSRDWBDV-UHFFFAOYSA-N	-1	0	182.606	2.681	30	0		AFACRM
Fc1cc(Cl)cc(F)c1[S-]	40571922	207352533	/nfs/dbraw/zinc/35/25/33/207352533.db2.gz	FRJVNMNZFBLJFD-UHFFFAOYSA-N	-1	0	180.606	2.907	30	0		AFACRM
[S-]c1ccc(OC2CC2)cc1	40571369	207352740	/nfs/dbraw/zinc/35/27/40/207352740.db2.gz	WYSZFIVENXNTCK-UHFFFAOYSA-N	-1	0	166.245	2.517	30	0		AFACRM
CC(C)Oc1ccccc1[S-]	39198706	343205817	/nfs/dbraw/zinc/20/58/17/343205817.db2.gz	XGMRHSDVJHSXPS-UHFFFAOYSA-N	-1	0	168.261	2.763	30	0		AFACRM
Cc1c(F)ccc([S-])c1F	71792189	343558944	/nfs/dbraw/zinc/55/89/44/343558944.db2.gz	GSDJBDIANVNUSN-UHFFFAOYSA-N	-1	0	160.188	2.562	30	0		AFACRM