GPCRdb

CHEMBL3613876

Agent/drug
Bioactivity

CHEMBL3613876

SMILES	O=Cc1cnn2ccc(-n3cc(CCN4CCN(c5cccc(Cl)c5Cl)CC4)nn3)cc12
InChIKey	CUAINFDJRFUIDT-UHFFFAOYSA-N

Chemical Properties

Hydrogen bond acceptors	8
Hydrogen bond donors	0
Rotatable bonds	6
Molecular weight (Da)	469.1

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_2A	5HT2A	Human	5-Hydroxytryptamine	A	pKi	7.30	7.30	7.30	ChEMBL
D₁	DRD1	Human	Dopamine	A	pKi	6.80	6.80	6.80	ChEMBL
D₂	DRD2	Human	Dopamine	A	pKi	7.96	8.03	8.10	ChEMBL
D₃	DRD3	Human	Dopamine	A	pKi	7.50	7.50	7.50	ChEMBL
D₄	DRD4	Human	Dopamine	A	pKi	5.52	5.52	5.52	ChEMBL

Showing 1 to 5 of 5 entries

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

D₂	DRD2	Human	Dopamine	A	pEC50	5.45	6.08	6.70	ChEMBL

Showing 1 to 1 of 1 entry

CHEMBL3613876

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.