GPCRdb

CHEMBL3613878

Agent/drug
Bioactivity

CHEMBL3613878

SMILES	Clc1cccc(N2CCN(CCc3cn(-c4ccn5nccc5c4)nn3)CC2)c1Cl
InChIKey	HMVJSLZLZZJKHU-UHFFFAOYSA-N

Chemical Properties

Hydrogen bond acceptors	7
Hydrogen bond donors	0
Rotatable bonds	5
Molecular weight (Da)	441.1

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	8.15	8.15	8.15	ChEMBL
D₁	DRD1	Human	Dopamine	A	pKi	6.92	6.92	6.92	ChEMBL
D₂	DRD2	Human	Dopamine	A	pKi	7.66	7.83	8.00	ChEMBL
D₃	DRD3	Human	Dopamine	A	pKi	8.66	8.66	8.66	ChEMBL
D₄	DRD4	Human	Dopamine	A	pKi	6.75	6.75	6.75	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	5.96	6.14	6.32	ChEMBL

Showing 1 to 1 of 1 entry

CHEMBL3613878

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.