smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C[C@@H](Cc1ccc(F)c(Br)c1)NC(=O)C1CC2(C1)NC(=O)[N-]C2=O	ZINC000160933831	530556195	/nfs/dbraw/zinc/55/61/95/530556195.db2.gz	WXNSJOLFABSZTA-GTVJLWQTSA-N	-1	3	398.232	1.624	10	70		GDIEHM
CC(=O)NCCc1ccc(S(=O)(=O)[N-]C[C@H]2CCCN2CC(C)C)s1	ZINC000160283705	530550322	/nfs/dbraw/zinc/55/03/22/530550322.db2.gz	JZSCYPPERIURPG-OAHLLOKOSA-N	-1	3	387.571	1.825	10	70		GDIEHM
O=C(NCC1(c2ccccc2Br)CC1)C1CC2(C1)NC(=O)[N-]C2=O	ZINC000159658030	530545316	/nfs/dbraw/zinc/54/53/16/530545316.db2.gz	UOWZBFAGIFCKSV-UHFFFAOYSA-N	-1	3	392.253	1.585	10	70		GDIEHM
C[C@H](Cc1ccc(F)c(Br)c1)NC(=O)C1CC2(C1)NC(=O)[N-]C2=O	ZINC000160933945	530555727	/nfs/dbraw/zinc/55/57/27/530555727.db2.gz	WXNSJOLFABSZTA-MXYVJXLBSA-N	-1	3	398.232	1.624	10	70		GDIEHM
C[C@H](Cc1ccccc1Br)NC(=O)C1CC2(C1)NC(=O)[N-]C2=O	ZINC000160759470	530554719	/nfs/dbraw/zinc/55/47/19/530554719.db2.gz	WJZFFVFORUUASP-GRBIUAATSA-N	-1	3	380.242	1.485	10	70		GDIEHM
O=C(NC1(c2cccc(Br)c2)CC1)C1CC2(C1)NC(=O)[N-]C2=O	ZINC000159495805	530544139	/nfs/dbraw/zinc/54/41/39/530544139.db2.gz	GHVBRSGZFYSJTJ-UHFFFAOYSA-N	-1	3	378.226	1.543	10	70		GDIEHM
C[C@@H](Cc1ccccc1Br)NC(=O)C1CC2(C1)NC(=O)[N-]C2=O	ZINC000160759358	530554643	/nfs/dbraw/zinc/55/46/43/530554643.db2.gz	WJZFFVFORUUASP-BAJKAOOYSA-N	-1	3	380.242	1.485	10	70		GDIEHM