GPCRdb

CHEMBL3545622

Agent/drug
Bioactivity

CHEMBL3545622

SMILES	CN(C)[C@]1(c2ccccc2)CC[C@]2(CC1)OCCc1c3cc(O)ccc3[nH]c12
InChIKey	KFKGRKGKOJKTPF-RQNOJGIXSA-N

Chemical Properties

Hydrogen bond acceptors	3
Hydrogen bond donors	2
Rotatable bonds	2
Molecular weight (Da)	376.2

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

μ	OPRM	Human	Opioid	A	pKi	9.40	9.40	9.40	ChEMBL
NOP	OPRX	Human	Opioid	A	pKi	9.00	9.00	9.00	ChEMBL

Showing 1 to 2 of 2 entries

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

μ	OPRM	Human	Opioid	A	pEC50	8.92	8.92	8.92	ChEMBL
NOP	OPRX	Human	Opioid	A	pEC50	6.92	6.92	6.92	ChEMBL

Showing 1 to 2 of 2 entries

CHEMBL3545622

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.