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(CCn1cc(Br)ccc1=O)NC[C@@H](O)CN1CCCCC1	ZINC000160441156	530560660	/nfs/dbraw/zinc/56/06/60/530560660.db2.gz	UUOWDXGQQKYYTC-CQSZACIVSA-N	0	3	386.290	0.964	20	70		GCIDHN
C[NH2+][C@H]1CCN(C(=O)C[N-]S(=O)(=O)c2ccc(Br)s2)C1	ZINC000160802143	530330893	/nfs/dbraw/zinc/33/08/93/530330893.db2.gz	AFFCNZMZOWQNEP-QMMMGPOBSA-N	0	3	382.305	0.609	20	70		GCIDHN
C[C@H](CNC(=O)C(=O)Nc1ccc(Br)nc1)CN1CCN(C)CC1	ZINC000160394397	530330427	/nfs/dbraw/zinc/33/04/27/530330427.db2.gz	VEWWTHMCDMWNRD-GFCCVEGCSA-N	0	3	398.305	0.782	20	70		GCIDHN
C[C@@H](CNC(=O)C(=O)Nc1ccc(Br)nc1)CN1CCN(C)CC1	ZINC000160394250	530330351	/nfs/dbraw/zinc/33/03/51/530330351.db2.gz	VEWWTHMCDMWNRD-LBPRGKRZSA-N	0	3	398.305	0.782	20	70		GCIDHN
O=C(CCn1cc(Br)ccc1=O)NC[C@H](O)CN1CCCCC1	ZINC000160441031	530560704	/nfs/dbraw/zinc/56/07/04/530560704.db2.gz	UUOWDXGQQKYYTC-AWEZNQCLSA-N	0	3	386.290	0.964	20	70		GCIDHN
C[NH2+][C@@H]1CCN(C(=O)C[N-]S(=O)(=O)c2ccc(Br)s2)C1	ZINC000160802012	530330940	/nfs/dbraw/zinc/33/09/40/530330940.db2.gz	AFFCNZMZOWQNEP-MRVPVSSYSA-N	0	3	382.305	0.609	20	70		GCIDHN