GPCRdb

CHEMBL4300899

Agent/drug
Bioactivity

CHEMBL4300899

SMILES	COc1ccccc1N1CCN(CCCOc2ccc(C)cc2C)CC1
InChIKey	RRGONONIXNMNQE-UHFFFAOYSA-N

Chemical Properties

Hydrogen bond acceptors	4
Hydrogen bond donors	0
Rotatable bonds	7
Molecular weight (Da)	354.2

Database connections

ChEMBL_compound_ids ChEMBL_compound_ids PubChem GPCRdb

Bioactivities

Affinity
Potency

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

α_1A	ADA1A	Human	Adrenoceptors	A	pKi	7.96	7.96	7.96	ChEMBL
5-HT_1A	5HT1A	Human	5-Hydroxytryptamine	A	pKi	8.70	8.70	8.70	ChEMBL
5-HT_2A	5HT2A	Human	5-Hydroxytryptamine	A	pKi	6.28	6.28	6.28	ChEMBL
5-HT₇	5HT7R	Human	5-Hydroxytryptamine	A	pKi	7.82	7.82	7.82	ChEMBL
D₂	DRD2	Human	Dopamine	A	pKi	7.01	7.01	7.01	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	Human	5-Hydroxytryptamine	A	pIC50	8.14	8.14	8.14	ChEMBL
5-HT₇	5HT7R	Human	5-Hydroxytryptamine	A	pIC50	5.98	5.98	5.98	ChEMBL
D₂	DRD2	Human	Dopamine	A	pIC50	7.75	7.75	7.75	ChEMBL

Showing 1 to 3 of 3 entries

CHEMBL4300899

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 ChEMBL_compound_ids PubChem GPCRdb

Compound is not listed as a drug.