GPCRdb

CHEMBL398175

Agent/drug
Bioactivity

CHEMBL398175

SMILES	Cc1cccc(-c2ccc(C(=O)NC/C=C/CN3CCN(c4cccc(Cl)c4Cl)CC3)cc2)n1
InChIKey	IEANVAFYLZJSPC-NSCUHMNNSA-N

Chemical Properties

Hydrogen bond acceptors	4
Hydrogen bond donors	1
Rotatable bonds	7
Molecular weight (Da)	494.2

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	6.51	6.51	6.51	ChEMBL
5-HT_2A	5HT2A	Human	5-Hydroxytryptamine	A	pKi	7.03	7.03	7.03	ChEMBL
5-HT_2C	5HT2C	Human	5-Hydroxytryptamine	A	pKi	7.02	7.02	7.02	ChEMBL
D₂	DRD2	Human	Dopamine	A	pKi	6.98	6.98	6.98	ChEMBL
D₃	DRD3	Human	Dopamine	A	pKi	8.85	8.85	8.85	ChEMBL

Showing 1 to 5 of 5 entries

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

D₂	DRD2	Human	Dopamine	A	pIC50	5.89	5.89	5.89	ChEMBL
D₃	DRD3	Human	Dopamine	A	pIC50	8.17	8.17	8.17	ChEMBL

Showing 1 to 2 of 2 entries

CHEMBL398175

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.