smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C[NH+](C)C=Cc1[n-]c(=O)[nH]c(=O)c1[N+](=O)[O-]	ZINC000000245623	172350742	/nfs/dbraw/zinc/35/07/42/172350742.db2.gz	YLWAFVBXTFWGLP-ONEGZZNKSA-N	0	2	226.192	-0.496	50	5		BBBALN
Cn1c(=O)nc2[nH]cc([N+](=O)[O-])cc-2c1=O	ZINC000000339428	344701583	/nfs/dbraw/zinc/70/15/83/344701583.db2.gz	WXUHPWAFUHYRPW-UHFFFAOYSA-N	0	2	222.160	-0.058	50	5		BBBALN
COC(=O)c1n[nH]c(C(=O)OC)c1[N+](=O)[O-]	ZINC000004837508	344475189	/nfs/dbraw/zinc/47/51/89/344475189.db2.gz	RRANRLASTUBGSJ-UHFFFAOYSA-N	0	2	229.148	-0.109	50	5		BBBALN
C[NH+](C)C=Cc1[n-]c(=O)[nH]c(=O)c1[N+](=O)[O-]	ZINC000033533911	172352458	/nfs/dbraw/zinc/35/24/58/172352458.db2.gz	YLWAFVBXTFWGLP-ARJAWSKDSA-N	0	2	226.192	-0.084	50	5		BBBALN