GPCRdb

CHEMBL379602

Agent/drug
Bioactivity

CHEMBL379602

SMILES	COc1ccccc1N1CCN(Cc2cnn(-c3ccccc3)c2)CC1
InChIKey	VFDZFYCKUWKAKM-UHFFFAOYSA-N

Chemical Properties

Hydrogen bond acceptors	5
Hydrogen bond donors	0
Rotatable bonds	5
Molecular weight (Da)	348.2

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_1A	5HT1A	Human	5-Hydroxytryptamine	A	pKi	8.17	8.17	8.17	ChEMBL
5-HT_2A	5HT2A	Pig	5-Hydroxytryptamine	A	pKi	5.89	5.89	5.89	ChEMBL
D₁	DRD1	Pig	Dopamine	A	pKi	6.00	6.00	6.00	ChEMBL
D₂	DRD2	Human	Dopamine	A	pKi	7.96	8.03	8.10	ChEMBL
D₃	DRD3	Human	Dopamine	A	pKi	7.46	7.46	7.46	ChEMBL
D₄	DRD4	Human	Dopamine	A	pKi	9.55	9.55	9.55	ChEMBL

Showing 1 to 6 of 6 entries

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

D₂	DRD2	Human	Dopamine	A	pEC50	9.55	9.61	9.66	ChEMBL
D₃	DRD3	Human	Dopamine	A	pEC50	9.68	9.68	9.68	ChEMBL
D₄	DRD4	Human	Dopamine	A	pEC50	9.22	9.22	9.22	ChEMBL

Showing 1 to 3 of 3 entries

CHEMBL379602

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.