GPCRdb

CHEMBL4294790

Agent/drug
Bioactivity

CHEMBL4294790

SMILES	CCCNC(=O)NCC1CCc2ccc3ccc(OC)cc3c21
InChIKey	FJZLFDXDGHUWEY-UHFFFAOYSA-N

Chemical Properties

Hydrogen bond acceptors	2
Hydrogen bond donors	2
Rotatable bonds	5
Molecular weight (Da)	312.2

Database connections

ChEMBL_compound_ids PubChem GPCRdb

Bioactivities

Affinity
Potency

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

5-HT_2C	5HT2C	Human	5-Hydroxytryptamine	A	pKi	6.72	6.72	6.72	ChEMBL
MT₁	MTR1A	Human	Melatonin	A	pKi	8.30	8.30	8.30	ChEMBL
MT₂	MTR1B	Human	Melatonin	A	pKi	9.70	9.70	9.70	ChEMBL

Showing 1 to 3 of 3 entries

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

MT₁	MTR1A	Human	Melatonin	A	pEC50	7.52	7.52	7.52	ChEMBL
MT₂	MTR1B	Human	Melatonin	A	pEC50	7.70	7.70	7.70	ChEMBL

Showing 1 to 2 of 2 entries

CHEMBL4294790

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 0

Database connections

ChEMBL_compound_ids PubChem GPCRdb

Compound is not listed as a drug.