GPCRdb

CHEMBL3139240

Agent/drug
Bioactivity

CHEMBL3139240

SMILES	CCN1CCN(c2nc(C)nc3c2nc(-c2ccccc2Cl)n3CC2CCOCC2)CC1
InChIKey	PGBKYWIIHKALFL-UHFFFAOYSA-N

Chemical Properties

Hydrogen bond acceptors	7
Hydrogen bond donors	0
Rotatable bonds	5
Molecular weight (Da)	454.2

Database connections

ChEMBL_compound_ids ChEMBL_compound_ids PubChem GPCRdb

Bioactivities

Affinity
Potency

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

CB₂	CNR2	Rat	Cannabinoid	A	pKi	7.64	7.64	7.64	ChEMBL
CB₂	CNR2	Human	Cannabinoid	A	pKi	7.28	7.28	7.28	ChEMBL

Showing 1 to 2 of 2 entries

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

CB₂	CNR2	Human	Cannabinoid	A	pEC50	7.92	7.92	7.92	ChEMBL

Showing 1 to 1 of 1 entry

CHEMBL3139240

Drug properties

Molecular type	Small molecule
Physiological/Surrogate	Surrogate
Approved drug	No

Distribution across phases (no. indications)

Phase I 0

Phase II 0

Phase III 0

Phase IV

Database connections

ChEMBL_compound_ids ChEMBL_compound_ids PubChem GPCRdb

Compound is not listed as a drug.