GPCRdb

CHEMBL423841

Agent/drug
Bioactivity

CHEMBL423841

SMILES	CCCN(CCCN1C(=O)c2ccccc2C1=O)C1COc2cccc(OC)c2C1
InChIKey	UWBMUVYDKVGMFO-UHFFFAOYSA-N

Chemical Properties

Hydrogen bond acceptors	5
Hydrogen bond donors	0
Rotatable bonds	8
Molecular weight (Da)	408.2

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

5-HT_1A	5HT1A	Rat	5-Hydroxytryptamine	A	pKi	7.30	7.30	7.30	ChEMBL

Showing 1 to 1 of 1 entry

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

α_1A	ADA1A	Bovine	Adrenoceptors	A	pIC50	5.40	5.40	5.40	ChEMBL
α_2A	ADA2A	Bovine	Adrenoceptors	A	pIC50	6.00	6.00	6.00	ChEMBL
5-HT_1A	5HT1A	Rat	5-Hydroxytryptamine	A	pIC50	7.00	7.00	7.00	ChEMBL
5-HT_1B	5HT1B	Rat	5-Hydroxytryptamine	A	pIC50	5.52	5.52	5.52	ChEMBL
5-HT_2A	5HT2A	Bovine	5-Hydroxytryptamine	A	pIC50	5.10	5.10	5.10	ChEMBL
D₁	DRD1	Bovine	Dopamine	A	pIC50	4.40	4.40	4.40	ChEMBL
D₂	DRD2	Bovine	Dopamine	A	pIC50	7.10	7.10	7.10	ChEMBL

Showing 1 to 7 of 7 entries

CHEMBL423841

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.