GPCRdb

CHEMBL4078348

Agent/drug
Bioactivity

CHEMBL4078348

SMILES	CCCN(CCCCOc1ccn2nccc2c1)[C@H]1CCc2c(O)cccc2C1
InChIKey	IWAHIMCMPBOXKG-FQEVSTJZSA-N

Chemical Properties

Hydrogen bond acceptors	5
Hydrogen bond donors	1
Rotatable bonds	9
Molecular weight (Da)	393.2

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_2A	5HT2A	Human	5-Hydroxytryptamine	A	pKi	5.92	5.92	5.92	ChEMBL
D₁	DRD1	Human	Dopamine	A	pKi	6.10	6.10	6.10	ChEMBL
D₂	DRD2	Human	Dopamine	A	pKi	8.68	8.91	9.15	ChEMBL
D₃	DRD3	Human	Dopamine	A	pKi	9.10	9.10	9.10	ChEMBL
D₄	DRD4	Human	Dopamine	A	pKi	8.92	8.92	8.92	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	7.26	8.63	9.92	ChEMBL
D₃	DRD3	Human	Dopamine	A	pEC50	9.37	9.37	9.37	ChEMBL

Showing 1 to 2 of 2 entries

CHEMBL4078348

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.