smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1ccc(C(C)C)c([O-])c1[N+](=O)[O-]	34439946	343119396	/nfs/dbraw/zinc/11/93/96/343119396.db2.gz	CYUYOFIGNXMLPJ-UHFFFAOYSA-N	-1	0	195.218	2.732	50	5		AFBARM
CC(C)(C)c1ccc([N+](=O)[O-])c([O-])c1	19801504	166383062	/nfs/dbraw/zinc/38/30/62/166383062.db2.gz	FQVUUPPMBGPBRL-UHFFFAOYSA-N	-1	0	195.218	2.598	50	5		AFBARM
CC(C)(C)c1ccc([O-])c([N+](=O)[O-])c1	19943782	166383995	/nfs/dbraw/zinc/38/39/95/166383995.db2.gz	IHGNADPMUSNTJW-UHFFFAOYSA-N	-1	0	195.218	2.598	50	5	in-vitro	AFBARM
CC[C@H](C)c1ccc([O-])c([N+](=O)[O-])c1	25629739	167635307	/nfs/dbraw/zinc/63/53/07/167635307.db2.gz	GCDCKEORRIGZKI-ZETCQYMHSA-N	-1	0	195.218	2.814	50	5		AFBARM
O=[N+]([O-])c1cc([S-])ccc1Cl	2586004	171008565	/nfs/dbraw/zinc/00/85/65/171008565.db2.gz	IAYMABJPMMKXFR-UHFFFAOYSA-N	-1	0	189.623	2.537	50	5		AFBARM
O=[N+]([O-])c1ccc([S-])c(Cl)c1	1737234	351298499	/nfs/dbraw/zinc/29/84/99/351298499.db2.gz	APOVVHFOZVRYTL-UHFFFAOYSA-N	-1	0	189.623	2.537	50	5	in-vitro	AFBARM
CC[C@@H](C)c1ccc([O-])c([N+](=O)[O-])c1	25629732	351418175	/nfs/dbraw/zinc/41/81/75/351418175.db2.gz	GCDCKEORRIGZKI-SSDOTTSWSA-N	-1	0	195.218	2.814	50	5		AFBARM