GPCRdb

CHEMBL1235128

Agent/drug
Bioactivity

CHEMBL1235128

SMILES	CCCNC(=O)[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O
InChIKey	UQGKLARJCHZHSS-QRIDJOKKSA-N

Chemical Properties

Hydrogen bond acceptors	9
Hydrogen bond donors	4
Rotatable bonds	4
Molecular weight (Da)	322.1

Database connections

ChEMBL_compound_ids PubChem GPCRdb

Bioactivities

Affinity
Potency

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

A₁	AA1R	Rat	Adenosine	A	pKi	5.40	5.74	5.91	ChEMBL
A₁	AA1R	Human	Adenosine	A	pKi	7.92	7.92	7.92	ChEMBL
A_2A	AA2AR	Rat	Adenosine	A	pKi	6.26	6.26	6.26	ChEMBL
A_2A	AA2AR	Human	Adenosine	A	pKi	6.68	6.68	6.68	ChEMBL
A₃	AA3R	Human	Adenosine	A	pKi	7.30	7.32	7.36	ChEMBL
oxoglutarate	OXGR1	Rat	Oxoglutarate	A	pKi	7.51	7.51	7.51	ChEMBL

Showing 1 to 6 of 6 entries

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

A_2B	AA2BR	Human	Adenosine	A	pEC50	4.54	4.54	4.54	ChEMBL

Showing 1 to 1 of 1 entry

CHEMBL1235128

Drug properties

Molecular type	Small molecule
Physiological/Surrogate	Surrogate
Approved drug	No

Clinical Trials

Phase I 0

Phase II 0

Phase III 0

Approved No

Database connections

ChEMBL_compound_ids PubChem GPCRdb

Compound is not listed as a drug.