GPCRdb

CHEMBL5410506

Agent/drug
Bioactivity

CHEMBL5410506

No image available

SMILES	CC(C)Oc1cc(Cl)ccc1CNc1cc(-c2ccccc2OCCCCCCNC(=O)c2ccc(-c3c4ccc(N(C)C)cc4[o+]c4cc(N(C)C)ccc34)c(C(=O)[O-])c2)nc2ncnn12
InChIKey	TZAXVGPREHBRRS-UHFFFAOYSA-N

Chemical Properties

Hydrogen bond acceptors	12
Hydrogen bond donors	2
Rotatable bonds	19
Molecular weight (Da)	920.4

Database connections

ChEMBL_compound_ids PubChem GPCRdb

Bioactivities

Affinity
Potency

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

GPR3	GPR3	Human	A orphans	A	pKd	6.52	6.75	6.99	ChEMBL
GPR3	GPR3	Human	A orphans	A	pKi	6.53	6.53	6.53	ChEMBL
GPR6	GPR6	Human	A orphans	A	pKd	7.18	7.18	7.18	ChEMBL
GPR6	GPR6	Human	A orphans	A	pKi	7.88	7.88	7.88	ChEMBL

Showing 1 to 4 of 4 entries

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

GPR3	GPR3	Human	A orphans	A	pEC50	5.85	5.95	6.05	ChEMBL
GPR3	GPR3	Human	A orphans	A	pIC50	5.90	5.90	5.90	ChEMBL
GPR6	GPR6	Human	A orphans	A	pIC50	6.67	6.67	6.67	ChEMBL

Showing 1 to 3 of 3 entries

CHEMBL5410506

No image available

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.