smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC(C)c1cc(C(C)C)c(Cl)c(Cl)c1[O-]	ZINC000001690835	342709569	/nfs/dbraw/zinc/70/95/69/342709569.db2.gz	NIOJGSGFABASGJ-UHFFFAOYSA-N	-1	3	247.165	4.946	40	0		BJABHM
CC(C)(C)CC(C)(C)c1ccc([O-])c(Cl)c1	ZINC000001700235	342709974	/nfs/dbraw/zinc/70/99/74/342709974.db2.gz	CLYCAZNGUGDEBH-UHFFFAOYSA-N	-1	3	240.774	4.759	40	0		BJABHM
S=c1[n-]c2ccccc2cc1CC1CCCC1	ZINC000013534568	183313286	/nfs/dbraw/zinc/31/32/86/183313286.db2.gz	FRBBUMFYMNYVCV-UHFFFAOYSA-N	-1	3	243.375	4.630	40	0		BJABHM
CC(C)(C)c1cc(Cl)c([O-])c(C(C)(C)C)c1	ZINC000014000418	346978518	/nfs/dbraw/zinc/97/85/18/346978518.db2.gz	CWSNVVXDGQVVDZ-UHFFFAOYSA-N	-1	3	240.774	4.641	40	0		BJABHM
CC(C)(C)c1ccc([O-])c2c(Cl)csc21	ZINC000228965671	519037680	/nfs/dbraw/zinc/03/76/80/519037680.db2.gz	ROOAHQQJOWZMMW-UHFFFAOYSA-N	-1	3	240.755	4.558	40	0		BJABHM