smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=C(/C=C/c1ccco1)c1cc(Cl)ccc1O	ZINC000004804526	385113673	/nfs/dbraw/zinc/11/36/73/385113673.db2.gz	WUUQATKGYNLGLM-GQCTYLIASA-N	0	2	248.665	3.535	50	30		BHEALN
O/N=C(\c1cc2ccccc2o1)c1ccccc1	ZINC000004811641	384080319	/nfs/dbraw/zinc/08/03/19/384080319.db2.gz	HKJPUKFSRLNVKF-NXVVXOECSA-N	0	2	237.258	3.659	50	30		BHEALN
O/N=C\c1ccccc1Oc1ccc(F)c(F)c1	ZINC000013397347	384360321	/nfs/dbraw/zinc/36/03/21/384360321.db2.gz	JGLVDIVHVFZUDA-PXNMLYILSA-N	0	2	249.216	3.565	50	30		BHEALN
N#Cc1ccc(-c2ccc(S)cc2)cc1	ZINC000034368074	181095134	/nfs/dbraw/zinc/09/51/34/181095134.db2.gz	ZZSHJNKMDIZSFY-UHFFFAOYSA-N	0	2	211.289	3.514	50	30		BHEALN
O/N=C(/c1cc2ccccc2o1)c1ccccc1	ZINC000100103959	384616668	/nfs/dbraw/zinc/61/66/68/384616668.db2.gz	HKJPUKFSRLNVKF-FOCLMDBBSA-N	0	2	237.258	3.659	50	30		BHEALN
CC(=O)C=C(C)Nc1ccccc1S	ZINC000100546129	191063417	/nfs/dbraw/zinc/06/34/17/191063417.db2.gz	PNKRZLKWLWZIDN-BRVZEXMBSA-N	0	2	207.298	3.530	50	30		BHEALN
CC(=O)C=C(C)Nc1ccccc1S	ZINC000252624407	364274873	/nfs/dbraw/zinc/27/48/73/364274873.db2.gz	PNKRZLKWLWZIDN-FIMQDFCFSA-N	0	2	207.298	3.530	50	30		BHEALN
CC(=O)C=C(C)Nc1ccccc1S	ZINC000252624408	364274514	/nfs/dbraw/zinc/27/45/14/364274514.db2.gz	PNKRZLKWLWZIDN-LIEVUWFWSA-N	0	2	207.298	3.530	50	30		BHEALN