GPCRdb

CHEMBL478413

Agent/drug
Bioactivity

CHEMBL478413

SMILES	c1ccc(N2CCN(CCCSc3nc4ccccc4s3)CC2)nc1
InChIKey	WFKQHFRAVGTTCE-UHFFFAOYSA-N

Chemical Properties

Hydrogen bond acceptors	6
Hydrogen bond donors	0
Rotatable bonds	6
Molecular weight (Da)	370.1

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_1A	5HT1A	Rat	5-Hydroxytryptamine	A	pKi	9.11	9.11	9.11	ChEMBL
5-HT_1A	5HT1A	Rat	5-Hydroxytryptamine	A	pKi	9.11	9.11	9.11	PDSP Ki database
D₁	DRD1	Rat	Dopamine	A	pKi	5.25	5.25	5.25	ChEMBL
D₁	DRD1	Rat	Dopamine	A	pKi	5.25	5.25	5.25	PDSP Ki database
D₂	DRD2	Rat	Dopamine	A	pKi	6.33	6.33	6.33	ChEMBL

Showing 1 to 5 of 5 entries

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

5-HT_1A	5HT1A	Rat	5-Hydroxytryptamine	A	pEC50	6.49	6.49	6.49	ChEMBL

Showing 1 to 1 of 1 entry

CHEMBL478413

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.