smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=[N+]([O-])c1c(O)ccc2c1CCCC2	21965164	171041326	/nfs/dbraw/zinc/04/13/26/171041326.db2.gz	UJZAWUHOEZMHNT-UHFFFAOYSA-N	0	1	193.202	2.179	40	5		AEBBMN
Cc1ccc(C(C)[N+](=O)[O-])cc1	1733868	342963118	/nfs/dbraw/zinc/96/31/18/342963118.db2.gz	UZBOCLNTFBKQNO-QMMMGPOBSA-N	0	1	165.192	2.333	40	5		AEBBMN
Cc1ccc(C(C)[N+](=O)[O-])cc1	2042261	342968964	/nfs/dbraw/zinc/96/89/64/342968964.db2.gz	UZBOCLNTFBKQNO-MRVPVSSYSA-N	0	1	165.192	2.333	40	5		AEBBMN
CN(C)/C=C/c1ccc([N+](=O)[O-])cc1	39236884	343207515	/nfs/dbraw/zinc/20/75/15/343207515.db2.gz	LPBAERIJGIWGFR-BQYQJAHWSA-N	0	1	192.218	2.127	40	5		AEBBMN
O=[N+]([O-])c1ccc(Cl)c2c[nH]nc12	4353785	351328992	/nfs/dbraw/zinc/32/89/92/351328992.db2.gz	MGCGMFQHBXYECU-UHFFFAOYSA-N	0	1	197.581	2.125	40	5	in-vitro	AEBBMN