GproteinDb

CHEMBL1258223

Agent/drug
Bioactivity

CHEMBL1258223

SMILES	CCCCN1CCC(COC(=O)c2cc(Cl)c(NC)c3c2OCCO3)CC1
InChIKey	WKWADEWWLCVVLF-UHFFFAOYSA-N

Chemical Properties

Hydrogen bond acceptors	6
Hydrogen bond donors	1
Rotatable bonds	7
Molecular weight (Da)	396.2

Database connections

ChEMBL_compound_ids PubChem GPCRdb

Bioactivities

Affinity
Potency

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

α_1A	ADA1A	Human	Adrenoceptors	A	pKi	6.28	6.28	6.28	ChEMBL
α_1D	ADA1D	Human	Adrenoceptors	A	pKi	5.64	5.64	5.64	ChEMBL
α_2A	ADA2A	Human	Adrenoceptors	A	pKi	5.65	5.65	5.65	ChEMBL
α_2B	ADA2B	Human	Adrenoceptors	A	pKi	6.17	6.17	6.17	ChEMBL
α_2C	ADA2C	Human	Adrenoceptors	A	pKi	6.25	6.25	6.25	ChEMBL
5-HT_1A	5HT1A	Human	5-Hydroxytryptamine	A	pKi	6.52	6.52	6.52	ChEMBL
5-HT_1B	5HT1B	Human	5-Hydroxytryptamine	A	pKi	6.09	6.09	6.09	ChEMBL
5-HT_1D	5HT1D	Human	5-Hydroxytryptamine	A	pKi	5.88	5.88	5.88	ChEMBL
5-HT_1E	5HT1E	Human	5-Hydroxytryptamine	A	pKi	5.00	5.00	5.00	ChEMBL
5-HT_2A	5HT2A	Human	5-Hydroxytryptamine	A	pKi	5.75	5.75	5.75	ChEMBL
5-HT_2B	5HT2B	Human	5-Hydroxytryptamine	A	pKi	7.18	7.18	7.18	ChEMBL
5-HT_2C	5HT2C	Human	5-Hydroxytryptamine	A	pKi	6.16	6.16	6.16	ChEMBL
5-HT₄	5HT4R	Human	5-Hydroxytryptamine	A	pKi	8.70	8.70	8.70	ChEMBL
5-HT_5A	5HT5A	Human	5-Hydroxytryptamine	A	pKi	5.07	5.07	5.07	ChEMBL
5-HT₆	5HT6R	Human	5-Hydroxytryptamine	A	pKi	6.31	6.31	6.31	ChEMBL
5-HT₇	5HT7R	Human	5-Hydroxytryptamine	A	pKi	5.24	5.24	5.24	ChEMBL
D₁	DRD1	Rat	Dopamine	A	pKi	5.64	5.64	5.64	ChEMBL
D₂	DRD2	Rat	Dopamine	A	pKi	6.66	6.66	6.66	ChEMBL
D₃	DRD3	Rat	Dopamine	A	pKi	6.47	6.47	6.47	ChEMBL
D₄	DRD4	Rat	Dopamine	A	pKi	7.37	7.37	7.37	ChEMBL

Showing 1 to 20 of 26 entries

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

5-HT₄	5HT4R	Human	5-Hydroxytryptamine	A	pEC50	7.85	7.85	7.85	ChEMBL

Showing 1 to 1 of 1 entry

CHEMBL1258223

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 0

Database connections

ChEMBL_compound_ids PubChem GPCRdb

Compound is not listed as a drug.