smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCOC(=O)c1nc(Cl)nc(N2CCC3(CCCN3CC(=O)NC)CC2)c1[N+](=O)[O-]	ZINC001164681728	719700966	/nfs/dbraw/zinc/70/09/66/719700966.db2.gz	ADDQRRBQSNDVKL-UHFFFAOYSA-N	0	3	440.888	1.396	20	5		IDBDHN
CN(C)/C=C\c1cc(N2CCn3cc(CN4CCN(C)CC4)nc3C2)ncc1[N+](=O)[O-]	ZINC001164799239	721519051	/nfs/dbraw/zinc/51/90/51/721519051.db2.gz	ZSOLXUVFWOJVPP-PLNGDYQASA-N	0	3	426.525	1.486	20	5		IDBDHN
CCOC(=O)C1CCN(C2CCN(c3nc(NC(C)=O)nc(C)c3[N+](=O)[O-])CC2)CC1	ZINC001164618628	719035396	/nfs/dbraw/zinc/03/53/96/719035396.db2.gz	WIVFVDITMVMXOW-UHFFFAOYSA-N	0	3	434.497	1.896	20	5		IDBDHN
CNC(=O)CN1CCCC12CCN(c1nc(Cl)nc(C(=O)OC)c1[N+](=O)[O-])CC2	ZINC001164682462	719705447	/nfs/dbraw/zinc/70/54/47/719705447.db2.gz	DYDDMGSMYMTDCZ-UHFFFAOYSA-N	0	3	426.861	1.006	20	5		IDBDHN
CN(C)/C=C/c1cc(N2CCn3cc(CN4CCN(C)CC4)nc3C2)ncc1[N+](=O)[O-]	ZINC001164799240	721518758	/nfs/dbraw/zinc/51/87/58/721518758.db2.gz	ZSOLXUVFWOJVPP-SNAWJCMRSA-N	0	3	426.525	1.486	20	5		IDBDHN