GPCRdb

CHEMBL27991

Agent/drug
Bioactivity

CHEMBL27991

SMILES	CCCN(CCCCNC(=O)c1ccc(F)cc1)C1COc2cccc(OC)c2C1
InChIKey	DDRVCPLCPBHTHJ-UHFFFAOYSA-N

Chemical Properties

Hydrogen bond acceptors	4
Hydrogen bond donors	1
Rotatable bonds	10
Molecular weight (Da)	414.2

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

5-HT_1A	5HT1A	Rat	5-Hydroxytryptamine	A	pKi	9.70	9.70	9.70	ChEMBL

Showing 1 to 1 of 1 entry

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

α_1A	ADA1A	Bovine	Adrenoceptors	A	pIC50	5.70	5.70	5.70	ChEMBL
α_2A	ADA2A	Bovine	Adrenoceptors	A	pIC50	5.40	5.40	5.40	ChEMBL
5-HT_1A	5HT1A	Rat	5-Hydroxytryptamine	A	pIC50	9.40	9.40	9.40	ChEMBL
5-HT_1B	5HT1B	Rat	5-Hydroxytryptamine	A	pIC50	5.52	5.52	5.52	ChEMBL
5-HT_2A	5HT2A	Bovine	5-Hydroxytryptamine	A	pIC50	5.52	5.52	5.52	ChEMBL
D₁	DRD1	Bovine	Dopamine	A	pIC50	4.70	4.70	4.70	ChEMBL
D₂	DRD2	Bovine	Dopamine	A	pIC50	8.15	8.15	8.15	ChEMBL

Showing 1 to 7 of 7 entries

CHEMBL27991

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.