GPCRdb

CHEMBL4216860

Agent/drug
Bioactivity

CHEMBL4216860

SMILES	COC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H]1N=C(c2ccccc2O)S[C@@H]1C
InChIKey	WSMFZWOSGRIXPV-DGFSRKRXSA-N

Chemical Properties

Hydrogen bond acceptors	7
Hydrogen bond donors	3
Rotatable bonds	6
Molecular weight (Da)	388.1

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_1D	5HT1D	Human	5-Hydroxytryptamine	A	pKi	5.48	5.48	5.48	ChEMBL
5-HT_1E	5HT1E	Human	5-Hydroxytryptamine	A	pKi	5.85	5.85	5.85	ChEMBL
5-HT_2A	5HT2A	Human	5-Hydroxytryptamine	A	pKi	6.51	6.51	6.51	ChEMBL
5-HT_2B	5HT2B	Human	5-Hydroxytryptamine	A	pKi	6.00	6.00	6.00	ChEMBL
5-HT_2C	5HT2C	Human	5-Hydroxytryptamine	A	pKi	6.09	6.09	6.09	ChEMBL

Showing 1 to 5 of 5 entries

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

5-HT_2B	5HT2B	Human	5-Hydroxytryptamine	A	pIC50	5.00	5.00	5.00	ChEMBL

Showing 1 to 1 of 1 entry

CHEMBL4216860

Drug properties

Molecular type	Small molecule
Physiological/Surrogate	Surrogate
Approved drug	No

Clinical Trials

Phase I 0

Phase II 0

Phase III 0

Approved No

Database connections

ChEMBL_compound_ids PubChem GPCRdb

Compound is not listed as a drug.