GPCRdb

CHEMBL519100

Agent/drug
Bioactivity

CHEMBL519100

SMILES	CC1(N2CCC(n3c(-c4cccc(C(F)(F)F)c4)nc4ccccc43)CC2)CCCCCCC1
InChIKey	HQBSTEJSIZHCBP-UHFFFAOYSA-N

Chemical Properties

Hydrogen bond acceptors	3
Hydrogen bond donors	0
Rotatable bonds	3
Molecular weight (Da)	469.3

Database connections

ChEMBL_compound_ids PubChem GPCRdb

Bioactivities

Affinity
Potency

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

δ	OPRD	Human	Opioid	A	pKi	7.24	7.24	7.24	ChEMBL
κ	OPRK	Human	Opioid	A	pKi	6.45	6.45	6.45	ChEMBL
μ	OPRM	Human	Opioid	A	pKi	7.19	7.19	7.19	ChEMBL
NOP	OPRX	Human	Opioid	A	pKi	9.20	9.20	9.20	ChEMBL

Showing 1 to 4 of 4 entries

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

κ	OPRK	Human	Opioid	A	pEC50	5.80	5.80	5.80	ChEMBL
μ	OPRM	Human	Opioid	A	pEC50	5.00	5.00	5.00	ChEMBL
NOP	OPRX	Human	Opioid	A	pEC50	8.24	8.24	8.24	ChEMBL

Showing 1 to 3 of 3 entries

CHEMBL519100

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 PubChem GPCRdb

Compound is not listed as a drug.