OC[C@@H]1O[C@@H](OCCc2ccc(O)cc2)[C@@H](O)[C@H](O)[C@H]1O	ZINC000000895992	29/51/83/373295183	ILRCGYURZSFMEG-PDWCTOEPSA-N	0	300.307	DA	-1.249	0	Anodyne	ref	DAAARN	OC[C@@H]1O[C@@H](OCCc2ccc(O)cc2)[C@@H](O)[C@H](O)[C@H]1O	 
O=c1[nH]c(=O)n([C@H]2C[C@H](O)[C@@H](CO)O2)cc1Br	ZINC000001081243	31/02/84/373310284	WOVKYSAHUYNSMH-RRKCRQDMSA-N	-1	307.1	DA	-1.06	3	Anodyne	high	DAAAHM	O=c1[n-]c(=O)n([C@H]2C[C@H](O)[C@@H](CO)O2)cc1Br	investigational
O=c1[nH]c(=O)n([C@H]2C[C@H](O)[C@@H](CO)O2)cc1Br	ZINC000001081243	31/02/70/373310270	WOVKYSAHUYNSMH-RRKCRQDMSA-N	0	307.1	DA	-1.06	0	Anodyne	ref	DAAARN	O=c1[nH]c(=O)n([C@H]2C[C@H](O)[C@@H](CO)O2)cc1Br	investigational
C[C@]1(Cn2ccnn2)[C@@H](C(=O)O)N2C(=O)C[C@H]2S1(=O)=O	ZINC000001483277	44/82/35/373448235	LPQZKKCYTLCDGQ-MRTMQBJTSA-N	-1	300.296	DA	-1.523	0	Anodyne	ref	DAABRM	C[C@]1(Cn2ccnn2)[C@@H](C(=O)[O-])N2C(=O)C[C@H]2S1(=O)=O	in-man
O=c1ccc2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2o1	ZINC000001559620	76/19/42/372761942	VPAOSFFTKWUGAD-TVKJYDDYSA-N	0	324.285	DA	-1.028	0	Anodyne	ref	DAAARN	O=c1ccc2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2o1	in-vitro biogenic
CC(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O	ZINC000002504638	13/40/86/278134086	GUCKKCMJTSNWCU-BQBZGAKWSA-N	-3	304.255	DA	-1.6	0	Anodyne	ref	DAAARL	CC(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)[O-])C(=O)[O-])C(=O)[O-]	world
OC[C@@H]1O[C@H](OCCc2ccc(O)cc2)[C@@H](O)[C@H](O)[C@H]1O	ZINC000002558150	30/98/73/373309873	ILRCGYURZSFMEG-HPCHECBXSA-N	0	300.307	DA	-1.249	0	Anodyne	ref	DAAARN	OC[C@@H]1O[C@H](OCCc2ccc(O)cc2)[C@@H](O)[C@H](O)[C@H]1O	 
C[C@]1(Cn2ccnn2)[C@H](C(=O)O)N2C(=O)C[C@H]2S1(=O)=O	ZINC000003787060	04/58/63/181045863	LPQZKKCYTLCDGQ-WEDXCCLWSA-N	-1	300.296	DA	-1.523	0	Anodyne	ref	DAAARM	C[C@]1(Cn2ccnn2)[C@H](C(=O)[O-])N2C(=O)C[C@H]2S1(=O)=O	fda
CC(=O)N[C@@H]1[C@@H](O)C[C@@](O)(C(=O)O)O[C@H]1[C@H](O)[C@H](O)CO	ZINC000003793840	04/62/07/181046207	SQVRNKJHWKZAKO-PFQGKNLYSA-N	-1	309.271	DA	-3.872	0	Anodyne	ref	DAAARM	CC(=O)N[C@@H]1[C@@H](O)C[C@@](O)(C(=O)[O-])O[C@H]1[C@H](O)[C@H](O)CO	in-man endogenous
Cn1nc(N)c2cn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c3ncnc1c23	ZINC000003808299	04/62/63/181046263	HOGVTUZUJGHKPL-HTVVRFAVSA-N	0	320.309	DA	-1.488	3	Anodyne	high	DAAAHN	Cn1nc(N)c2cn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c3ncnc1c23	investigational
Cn1nc(N)c2cn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c3ncnc1c23	ZINC000003808299	04/62/60/181046260	HOGVTUZUJGHKPL-HTVVRFAVSA-N	1	320.309	DA	-1.488	0	Anodyne	ref	DAAARO	Cn1[nH+]c(N)c2cn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c3ncnc1c23	investigational
N[C@@H](CCC(=O)N[C@@H](CS)C(=O)NCC(=O)O)C(=O)O	ZINC000003830891	44/86/21/303448621	RWSXRVCMGQZWBV-WDSKDSINSA-N	-1	307.328	DA	-2.206	0	Mild	ref	DAEARM	[NH3+][C@@H](CCC(=O)N[C@@H](CS)C(=O)NCC(=O)[O-])C(=O)[O-]	fda endogenous
N[C@@H](CCC(=O)N[C@H](CS)C(=O)NCC(=O)O)C(=O)O	ZINC000003830892	76/68/01/372766801	RWSXRVCMGQZWBV-NTSWFWBYSA-N	-1	307.328	DA	-2.206	0	Mild	ref	DAEARM	[NH3+][C@@H](CCC(=O)N[C@H](CS)C(=O)NCC(=O)[O-])C(=O)[O-]	in-vitro
N[C@H](CCC(=O)N[C@@H](CS)C(=O)NCC(=O)O)C(=O)O	ZINC000003830893	76/60/26/372766026	RWSXRVCMGQZWBV-RITPCOANSA-N	-1	307.328	DA	-2.206	0	Mild	ref	DAEARM	[NH3+][C@H](CCC(=O)N[C@@H](CS)C(=O)NCC(=O)[O-])C(=O)[O-]	in-vitro biogenic
N[C@H](CCC(=O)N[C@H](CS)C(=O)NCC(=O)O)C(=O)O	ZINC000003830894	47/99/89/303479989	RWSXRVCMGQZWBV-PHDIDXHHSA-N	-1	307.328	DA	-2.206	0	Mild	ref	DAEARM	[NH3+][C@H](CCC(=O)N[C@H](CS)C(=O)NCC(=O)[O-])C(=O)[O-]	in-vitro
C[C@]1(Cn2ccnn2)[C@H](C(=O)O)N2C(=O)C[C@@H]2S1(=O)=O	ZINC000003831502	04/80/56/181048056	LPQZKKCYTLCDGQ-NRPADANISA-N	-1	300.296	DA	-1.523	0	Anodyne	ref	DAAARM	C[C@]1(Cn2ccnn2)[C@H](C(=O)[O-])N2C(=O)C[C@@H]2S1(=O)=O	in-man
C[C@]1(Cn2ccnn2)[C@@H](C(=O)O)N2C(=O)C[C@@H]2S1(=O)=O	ZINC000003831504	44/82/68/373448268	LPQZKKCYTLCDGQ-XKSSXDPKSA-N	-1	300.296	DA	-1.523	0	Anodyne	ref	DAABRM	C[C@]1(Cn2ccnn2)[C@@H](C(=O)[O-])N2C(=O)C[C@@H]2S1(=O)=O	in-man
CC(=O)N[C@H]1[C@@H]([C@H](O)[C@H](O)CO)O[C@@](O)(C(=O)O)C[C@H]1O	ZINC000003870085	15/15/85/278151585	SQVRNKJHWKZAKO-VVSDMCKJSA-N	-1	309.271	DA	-3.872	0	Anodyne	ref	DAAARM	CC(=O)N[C@H]1[C@@H]([C@H](O)[C@H](O)CO)O[C@@](O)(C(=O)[O-])C[C@H]1O	in-vitro
CC(=O)N[C@H](CC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O	ZINC000004534089	12/10/52/181121052	GUCKKCMJTSNWCU-NKWVEPMBSA-N	-3	304.255	DA	-1.6	0	Anodyne	ref	DAAARL	CC(=O)N[C@H](CC(=O)N[C@@H](CCC(=O)[O-])C(=O)[O-])C(=O)[O-]	 
CC(=O)N[C@@H](CC(=O)N[C@H](CCC(=O)O)C(=O)O)C(=O)O	ZINC000004534090	12/08/73/181120873	GUCKKCMJTSNWCU-RQJHMYQMSA-N	-3	304.255	DA	-1.6	0	Anodyne	ref	DAAARL	CC(=O)N[C@@H](CC(=O)N[C@H](CCC(=O)[O-])C(=O)[O-])C(=O)[O-]	world
CC(=O)N[C@H](CC(=O)N[C@H](CCC(=O)O)C(=O)O)C(=O)O	ZINC000004534091	17/27/47/278172747	GUCKKCMJTSNWCU-RNFRBKRXSA-N	-3	304.255	DA	-1.6	0	Anodyne	ref	DAAARL	CC(=O)N[C@H](CC(=O)N[C@H](CCC(=O)[O-])C(=O)[O-])C(=O)[O-]	 
OC[C@H]1O[C@@H](OCCc2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O	ZINC000006092865	31/21/69/181312169	ILRCGYURZSFMEG-RKQHYHRCSA-N	0	300.307	DA	-1.249	0	Anodyne	ref	DAAARN	OC[C@H]1O[C@@H](OCCc2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O	in-vitro biogenic
Cn1nc(N)c2cn([C@@H]3O[C@H](CO)[C@@H](O)[C@@H]3O)c3ncnc1c23	ZINC000007992842	62/95/47/190629547	HOGVTUZUJGHKPL-LJUQJJLCSA-N	0	320.309	DA	-1.488	3	Anodyne	high	DAAAHN	Cn1nc(N)c2cn([C@@H]3O[C@H](CO)[C@@H](O)[C@@H]3O)c3ncnc1c23	in-vitro
Cn1nc(N)c2cn([C@@H]3O[C@H](CO)[C@@H](O)[C@@H]3O)c3ncnc1c23	ZINC000007992842	62/95/44/190629544	HOGVTUZUJGHKPL-LJUQJJLCSA-N	1	320.309	DA	-1.488	0	Anodyne	ref	DAAARO	Cn1[nH+]c(N)c2cn([C@@H]3O[C@H](CO)[C@@H](O)[C@@H]3O)c3ncnc1c23	in-vitro
Cn1nc(N)c2cn([C@@H]3O[C@H](CO)[C@H](O)[C@@H]3O)c3ncnc1c23	ZINC000013783254	80/22/15/372802215	HOGVTUZUJGHKPL-CEHQXXPXSA-N	0	320.309	DA	-1.488	3	Anodyne	high	DAAAHN	Cn1nc(N)c2cn([C@@H]3O[C@H](CO)[C@H](O)[C@@H]3O)c3ncnc1c23	in-vitro
Cn1nc(N)c2cn([C@@H]3O[C@H](CO)[C@H](O)[C@@H]3O)c3ncnc1c23	ZINC000013783254	80/22/02/372802202	HOGVTUZUJGHKPL-CEHQXXPXSA-N	1	320.309	DA	-1.488	0	Anodyne	ref	DAAARO	Cn1[nH+]c(N)c2cn([C@@H]3O[C@H](CO)[C@H](O)[C@@H]3O)c3ncnc1c23	in-vitro
CC(=O)N[C@H]1[C@@H]([C@@H](O)[C@@H](O)CO)O[C@@](O)(C(=O)O)C[C@H]1O	ZINC000015206143	99/19/54/181991954	SQVRNKJHWKZAKO-FALICOJDSA-N	-1	309.271	DA	-3.872	0	Anodyne	ref	DAAARM	CC(=O)N[C@H]1[C@@H]([C@@H](O)[C@@H](O)CO)O[C@@](O)(C(=O)[O-])C[C@H]1O	 
CC(=O)N[C@H]1[C@@H]([C@H](O)[C@@H](O)CO)O[C@@](O)(C(=O)O)C[C@H]1O	ZINC000015206146	15/15/53/278151553	SQVRNKJHWKZAKO-HHMWSCPNSA-N	-1	309.271	DA	-3.872	0	Anodyne	ref	DAAARM	CC(=O)N[C@H]1[C@@H]([C@H](O)[C@@H](O)CO)O[C@@](O)(C(=O)[O-])C[C@H]1O	in-vitro
Cn1nc(N)c2cn([C@@H]3O[C@H](CO)[C@H](O)[C@H]3O)c3ncnc1c23	ZINC000027646810	78/75/93/372787593	HOGVTUZUJGHKPL-GURMABIDSA-N	0	320.309	DA	-1.488	3	Anodyne	high	DAAAHN	Cn1nc(N)c2cn([C@@H]3O[C@H](CO)[C@H](O)[C@H]3O)c3ncnc1c23	in-vitro
Cn1nc(N)c2cn([C@@H]3O[C@H](CO)[C@H](O)[C@H]3O)c3ncnc1c23	ZINC000027646810	78/75/75/372787575	HOGVTUZUJGHKPL-GURMABIDSA-N	1	320.309	DA	-1.488	0	Anodyne	ref	DAAARO	Cn1[nH+]c(N)c2cn([C@@H]3O[C@H](CO)[C@H](O)[C@H]3O)c3ncnc1c23	in-vitro
CC(=O)N[C@H]1[C@@H]([C@@H](O)[C@H](O)CO)O[C@@](O)(C(=O)O)C[C@H]1O	ZINC000071789800	67/97/74/290679774	SQVRNKJHWKZAKO-ZQVBOCOSSA-N	-1	309.271	DA	-3.872	0	Anodyne	ref	DAAARM	CC(=O)N[C@H]1[C@@H]([C@@H](O)[C@H](O)CO)O[C@@](O)(C(=O)[O-])C[C@H]1O