GPCRdb

CHEMBL4060403

Agent/drug
Bioactivity

CHEMBL4060403

SMILES	O=Cc1cnn2ccc(NC(=O)CCCN3CCN(c4cccc(Cl)c4Cl)CC3)cc12
InChIKey	PMBZPLQKUNCRDH-UHFFFAOYSA-N

Chemical Properties

Hydrogen bond acceptors	6
Hydrogen bond donors	1
Rotatable bonds	7
Molecular weight (Da)	459.1

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	8.20	8.20	8.20	ChEMBL
D₁	DRD1	Human	Dopamine	A	pKi	6.68	6.68	6.68	ChEMBL
D₂	DRD2	Human	Dopamine	A	pKi	9.39	9.46	9.52	ChEMBL
D₃	DRD3	Human	Dopamine	A	pKi	8.77	8.77	8.77	ChEMBL
D₄	DRD4	Human	Dopamine	A	pKi	7.52	7.52	7.52	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	7.89	7.89	7.89	ChEMBL
D₃	DRD3	Human	Dopamine	A	pEC50	7.43	7.43	7.43	ChEMBL

Showing 1 to 2 of 2 entries

CHEMBL4060403

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.