O=C(O)c1c[nH]c(=O)[nH]c1=O	ZINC000000901606	35/60/01/169356001	ZXYAAVBXHKCJJB-UHFFFAOYSA-N	-2	156.097	AA	-1.239	3	Anodyne	high	AAAAHL	O=C([O-])c1c[nH]c(=O)[n-]c1=O	in-vitro
O=C(O)c1c[nH]c(=O)[nH]c1=O	ZINC000000901606	35/59/99/169355999	ZXYAAVBXHKCJJB-UHFFFAOYSA-N	-1	156.097	AA	-1.239	0	Anodyne	ref	AAAARM	O=C([O-])c1c[nH]c(=O)[nH]c1=O	in-vitro
O=c1c(O)c(O)c1=O	ZINC000001714721	00/16/45/171001645	PWEBUXCTKOWPCW-UHFFFAOYSA-N	-1	114.056	AA	-1.306	0	Anodyne	ref	AAAARM	O=c1c([O-])c(O)c1=O	in-vitro
O=P(O)(O)OC(CO)CO	ZINC000003830897	32/09/52/351320952	DHCLVCXQIBBOPH-UHFFFAOYSA-N	-2	172.073	AA	-1.551	0	Anodyne	ref	AAAARL	O=P([O-])([O-])OC(CO)CO	in-man endogenous
OC1CNC1	ZINC000004682874	33/26/04/351332604	GMWFCJXSQQHBPI-UHFFFAOYSA-N	0	73.095	AA	-1.05	3	Anodyne	high	AAAAHN	OC1CNC1	in-vitro
OC1CNC1	ZINC000004682874	33/25/96/351332596	GMWFCJXSQQHBPI-UHFFFAOYSA-N	1	73.095	AA	-1.05	0	Anodyne	ref	AAAARO	OC1C[NH2+]C1	in-vitro
C1CNCCNCCNCCN1	ZINC000005850273	01/88/44/171018844	QBPPRVHXOZRESW-UHFFFAOYSA-N	2	172.276	AA	-1.642	0	Anodyne	ref	AAAARP	C1C[NH2+]CCNCC[NH2+]CCN1	in-vitro
NC(=O)C1CNC1	ZINC000019685998	14/77/56/169147756	VALZSZJVEFACEZ-UHFFFAOYSA-N	1	100.121	AA	-1.309	0	Anodyne	ref	AAAARO	NC(=O)C1C[NH2+]C1