GPCRdb

CHEMBL4645193

Agent/drug
Bioactivity

CHEMBL4645193

No image available

SMILES	COc1c(OCCOCCOCCOCCOCCOCCOCCOCCOc2ccc(C3CCN(c4ccn5c(CC6CC6)nnc5c4Cl)CC3)cc2)cccc1C(=O)C1CCN(CCc2ccc(F)cc2)CC1
InChIKey	KEOUMVRTMMZTEV-UHFFFAOYSA-N

Chemical Properties

Hydrogen bond acceptors	16
Hydrogen bond donors	0
Rotatable bonds	36
Molecular weight (Da)	1073.5

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_2A	5HT2A	Human	5-Hydroxytryptamine	A	pKi	6.92	6.94	6.96	ChEMBL

Showing 1 to 1 of 1 entry

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

5-HT_2A	5HT2A	Human	5-Hydroxytryptamine	A	pIC50	6.39	6.39	6.39	ChEMBL
mGlu₂	GRM2	Human	Metabotropic glutamate	C	pEC50	5.80	6.05	6.29	ChEMBL

Showing 1 to 2 of 2 entries

CHEMBL4645193

No image available

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 PubChem GPCRdb

Compound is not listed as a drug.