smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC1(C)NC(=[NH2+])NC(=[NH2+])N1c1cccc(OCCOc2ccc([N+](=O)[O-])cc2)c1	ZINC000001703697	206390595	/nfs/dbraw/zinc/39/05/95/206390595.db2.gz	HQROZZWFLDQSEU-UHFFFAOYSA-N	2	1	398.423	2.238	40	5		GEBBMP
CC1(C)NC(=[NH2+])NC(=[NH2+])N1c1cccc(OCCOc2ccccc2[N+](=O)[O-])c1	ZINC000017040032	527780085	/nfs/dbraw/zinc/78/00/85/527780085.db2.gz	XVYDEIKHGOSGFH-UHFFFAOYSA-N	2	1	398.423	2.238	40	5		GEBBMP
CC1(C)NC(=[NH2+])NC(=[NH2+])N1c1cccc(OCCOc2cccc([N+](=O)[O-])c2)c1	ZINC000001703070	206389628	/nfs/dbraw/zinc/38/96/28/206389628.db2.gz	TURAAOATRLNIOG-UHFFFAOYSA-N	2	1	398.423	2.238	40	5		GEBBMP
CC1(C)NC(=[NH2+])NC(=[NH2+])N1c1ccc(OCCOc2ccc([N+](=O)[O-])cc2)cc1	ZINC000001710093	212254807	/nfs/dbraw/zinc/25/48/07/212254807.db2.gz	GQTPVBWPIUXQDS-UHFFFAOYSA-N	2	1	398.423	2.238	40	5		GEBBMP