smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCCn1[n-]cc/c1=N\C(=O)Cn1cnc2c(c(Br)nn2C)c1=O	ZINC000216656992	530492296	/nfs/dbraw/zinc/49/22/96/530492296.db2.gz	MKRBTYBKVIEPST-GIJQJNRQSA-N	-1	3	394.233	0.560	20	70		GCIDHM
C[C@@H](C[C@H](O)c1ccccc1)NC(=O)Cn1cc(Br)c(=O)[n-]c1=O	ZINC000159468598	530328839	/nfs/dbraw/zinc/32/88/39/530328839.db2.gz	WWZKGGUBZHROBR-GWCFXTLKSA-N	-1	3	396.241	0.928	20	70		GCIDHM
Cn1cnc(S(=O)(=O)[N-]CC(=O)NCCc2csc(C(C)(C)C)n2)c1	ZINC000160674304	530330951	/nfs/dbraw/zinc/33/09/51/530330951.db2.gz	RPXJAHBYXZCHIR-UHFFFAOYSA-N	-1	3	385.515	0.811	20	70		GCIDHM
C[C@H](C[C@@H](O)c1ccccc1)NC(=O)Cn1cc(Br)c(=O)[n-]c1=O	ZINC000159469005	530328796	/nfs/dbraw/zinc/32/87/96/530328796.db2.gz	WWZKGGUBZHROBR-ZWNOBZJWSA-N	-1	3	396.241	0.928	20	70		GCIDHM
O=C(Cn1cc(Br)c(=O)[n-]c1=O)N[C@H]1CCOC2(CCCC2)C1	ZINC000160198279	530330120	/nfs/dbraw/zinc/33/01/20/530330120.db2.gz	ZSZUBJIAZMUODV-JTQLQIEISA-N	-1	3	386.246	0.907	20	70		GCIDHM
C[C@@H](C[C@@H](O)c1ccccc1)NC(=O)Cn1cc(Br)c(=O)[n-]c1=O	ZINC000159468863	530328684	/nfs/dbraw/zinc/32/86/84/530328684.db2.gz	WWZKGGUBZHROBR-GXFFZTMASA-N	-1	3	396.241	0.928	20	70		GCIDHM
O=C(NCC[N-]S(=O)(=O)c1ccc(Cl)s1)NCCn1cccn1	ZINC000159689775	530313098	/nfs/dbraw/zinc/31/30/98/530313098.db2.gz	OATUHJRGKFBXJN-UHFFFAOYSA-N	-1	3	377.879	0.876	20	70		GCIDHM
O=C(Cn1cc(Br)c(=O)[n-]c1=O)N[C@@H]1CCOC2(CCCC2)C1	ZINC000160198149	530329998	/nfs/dbraw/zinc/32/99/98/530329998.db2.gz	ZSZUBJIAZMUODV-SNVBAGLBSA-N	-1	3	386.246	0.907	20	70		GCIDHM
C[C@H](C[C@H](O)c1ccccc1)NC(=O)Cn1cc(Br)c(=O)[n-]c1=O	ZINC000159468740	530328743	/nfs/dbraw/zinc/32/87/43/530328743.db2.gz	WWZKGGUBZHROBR-MFKMUULPSA-N	-1	3	396.241	0.928	20	70		GCIDHM