smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COc1ccc(C(=O)Nc2ccc(C(N)=O)cc2)cc1S(=O)(=O)N1CCN(C)CC1	ZINC000216785549	557153928	/nfs/dbraw/zinc/15/39/28/557153928.db2.gz	UDNQKGHYPIRDSN-UHFFFAOYSA-N	0	0	432.502	0.983	40	70		ICIBRN
COc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1C(=O)Nc1ccc(C(N)=O)cc1	ZINC000216788560	557154257	/nfs/dbraw/zinc/15/42/57/557154257.db2.gz	BUIWMVMVFUWIQU-UHFFFAOYSA-N	0	0	432.502	0.983	40	70		ICIBRN
CNS(=O)(=O)c1cc(C(=O)Nc2ccc(C(N)=O)cc2)ccc1N1CCN(C)CC1	ZINC000216791685	557154616	/nfs/dbraw/zinc/15/46/16/557154616.db2.gz	ABTSRNYQCXSPSJ-UHFFFAOYSA-N	0	0	431.518	0.698	40	70		ICIBRN
CCOC(=O)N1CCN(C(=O)c2ccc(C)c(S(=O)(=O)N3CCN(C)CC3)c2)CC1	ZINC000216854999	557157801	/nfs/dbraw/zinc/15/78/01/557157801.db2.gz	XTXFSPYBBRCSBW-UHFFFAOYSA-N	0	0	438.550	0.845	40	70		ICIBRN
CCOC(=O)N1CCN(C(=O)c2cc(S(=O)(=O)N3CCN(C)CC3)ccc2C)CC1	ZINC000216861569	557158625	/nfs/dbraw/zinc/15/86/25/557158625.db2.gz	IAYGOTKCWSYGMD-UHFFFAOYSA-N	0	0	438.550	0.845	40	70		ICIBRN
CN1CCN(S(=O)(=O)c2cc(C(=O)N3CCC(C(N)=O)CC3)ccc2Cl)CC1	ZINC000216870645	557160440	/nfs/dbraw/zinc/16/04/40/557160440.db2.gz	QNSWARPBCSUQKM-UHFFFAOYSA-N	0	0	428.942	0.614	40	70		ICIBRN
CN1CCN(S(=O)(=O)c2cc(C(=O)NCCN3CCOCC3)ccc2Cl)CC1	ZINC000216871533	557160552	/nfs/dbraw/zinc/16/05/52/557160552.db2.gz	RVKAKNCISBRFER-UHFFFAOYSA-N	0	0	430.958	0.338	40	70		ICIBRN
CN1CCN(S(=O)(=O)c2ccc(Cl)c(C(=O)N3CCC(C(N)=O)CC3)c2)CC1	ZINC000216877564	557160783	/nfs/dbraw/zinc/16/07/83/557160783.db2.gz	ZJYCGTXBCTYSFX-UHFFFAOYSA-N	0	0	428.942	0.614	40	70		ICIBRN
CN1CCN(S(=O)(=O)c2ccc(Cl)c(C(=O)NCCN3CCOCC3)c2)CC1	ZINC000216878961	557160748	/nfs/dbraw/zinc/16/07/48/557160748.db2.gz	HFTKBCGHBKFYJD-UHFFFAOYSA-N	0	0	430.958	0.338	40	70		ICIBRN
CN1CCN(S(=O)(=O)c2ccc(Cl)c(C(=O)NCCCN3CCOCC3)c2)CC1	ZINC000216879027	557160880	/nfs/dbraw/zinc/16/08/80/557160880.db2.gz	DZBAUBOBOLSBNQ-UHFFFAOYSA-N	0	0	444.985	0.728	40	70		ICIBRN