GPCRdb

CHEMBL3900245

Agent/drug
Bioactivity

CHEMBL3900245

SMILES	O=C(O)c1ccc(CC[C@H]2C(=O)CC[C@@H]2/C=C/C(O)Cc2cc(F)ccc2F)cc1
InChIKey	HNZZMMKIJHPUAD-WIPJZLDNSA-N

Chemical Properties

Hydrogen bond acceptors	3
Hydrogen bond donors	2
Rotatable bonds	8
Molecular weight (Da)	414.2

Database connections

ChEMBL_compound_ids PubChem GPCRdb

Bioactivities

Affinity
Potency

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

EP₂	PE2R2	Human	Prostanoid	A	pKi	5.44	5.67	5.89	ChEMBL
EP₄	PE2R4	Human	Prostanoid	A	pKi	6.34	7.32	8.30	ChEMBL

Showing 1 to 2 of 2 entries

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

EP₂	PE2R2	Human	Prostanoid	A	pEC50	6.90	7.45	8.00	ChEMBL
EP₃	PE2R3	Human	Prostanoid	A	pEC50	5.22	5.22	5.22	ChEMBL
EP₄	PE2R4	Human	Prostanoid	A	pEC50	7.75	8.72	9.70	ChEMBL

Showing 1 to 3 of 3 entries

CHEMBL3900245

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.