smiles	zinc_id	inchikey	mwt	logp	reactive	purchasable	tranche_name	features
O=[N+]([O-])c1cc(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc([N+](=O)[O-])c1	205483151	VNPOTVPDCPRUPK-YBXAARCKSA-N	346.248	-1.318	5	30	EABC	in-vitro
O=[N+]([O-])c1cc(O[C@@H]2O[C@H](CO)[C@H](O)[C@@H](O)[C@H]2O)cc([N+](=O)[O-])c1	102212937	VNPOTVPDCPRUPK-IYKVGLELSA-N	346.248	-1.318	5	30	EABC	in-vitro
CC(=O)N[C@H]1[C@H](Oc2ccccc2[N+](=O)[O-])O[C@H](CO)[C@H](O)[C@@H]1O	43505185	PXMQUEGJJUADKD-RKQHYHRCSA-N	342.304	-1.083	5	30	EABC	
O=[N+]([O-])c1cc(O[C@@H]2O[C@H](CO)[C@H](O)[C@@H](O)[C@@H]2O)cc([N+](=O)[O-])c1	102212942	VNPOTVPDCPRUPK-CSYMLDBXSA-N	346.248	-1.318	5	30	EABC	in-vitro
C[N+](C)(CCO)CCCNC(=O)[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO	5764694	GXXUNNMUTUOPQS-WISYIIOYSA-O	325.382	-4.003	5	30	EABC	
O=[N+]([O-])c1cc(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@@H]2O)cc([N+](=O)[O-])c1	247349194	VNPOTVPDCPRUPK-WTPMCQDGSA-N	346.248	-1.318	5	30	EABC	in-vitro
CC(=O)N[C@@H]1[C@H](Oc2ccc([N+](=O)[O-])cc2)O[C@@H](CO)[C@@H](O)[C@@H]1O	71788497	OMRLTNCLYHKQCK-ODXJTPSBSA-N	342.304	-1.083	5	30	EABC	in-vitro
Cc1ncc([N+](=O)[O-])n1CCO[C@H]1O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@@H]1O	575231559	KOVNZSSTXZPVCG-SSSAOXCUSA-N	347.280	-1.991	5	30	EABC