GPCRdb

CHEMBL105091

Agent/drug
Bioactivity

CHEMBL105091

SMILES	CN1CCC(c2c[nH]c3ccc(NC(=O)c4ccco4)nc23)CC1
InChIKey	YLMDJSLIPJEWKV-UHFFFAOYSA-N

Chemical Properties

Hydrogen bond acceptors	4
Hydrogen bond donors	2
Rotatable bonds	3
Molecular weight (Da)	324.2

Database connections

ChEMBL_compound_ids PubChem GPCRdb

Bioactivities

Affinity
Potency

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

5-HT_1A	5HT1A	Human	5-Hydroxytryptamine	A	pKi	6.25	6.25	6.25	ChEMBL
5-HT_1B	5HT1B	Human	5-Hydroxytryptamine	A	pKi	5.96	5.96	5.96	ChEMBL
5-HT_1D	5HT1D	Human	5-Hydroxytryptamine	A	pKi	6.03	6.03	6.03	ChEMBL
5-HT_1F	5HT1F	Human	5-Hydroxytryptamine	A	pKi	7.89	7.89	7.89	ChEMBL

Showing 1 to 4 of 4 entries

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

5-HT_1F	5HT1F	Human	5-Hydroxytryptamine	A	pEC50	7.96	7.96	7.96	ChEMBL

Showing 1 to 1 of 1 entry

CHEMBL105091

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.