GPCRdb

CHEMBL589973

Agent/drug
Bioactivity

CHEMBL589973

SMILES	CCCCNC(=O)c1ccc(Oc2ccc(CC(=O)O)cc2OC)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1
InChIKey	DKSKRBVXRDGYAS-UHFFFAOYSA-N

Chemical Properties

Hydrogen bond acceptors	6
Hydrogen bond donors	3
Rotatable bonds	12
Molecular weight (Da)	580.1

Database connections

ChEMBL_compound_ids PubChem GPCRdb

Bioactivities

Affinity
Potency

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

DP₁	PD2R	Human	Prostanoid	A	pKi	6.83	6.83	6.83	ChEMBL
DP₂	PD2R2	Human	Prostanoid	A	pKi	9.00	9.00	9.00	ChEMBL
EP₂	PE2R2	Human	Prostanoid	A	pKi	4.36	4.36	4.36	ChEMBL
EP₄	PE2R4	Human	Prostanoid	A	pKi	4.36	4.36	4.36	ChEMBL

Showing 1 to 4 of 4 entries

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

DP₁	PD2R	Human	Prostanoid	A	pIC50	6.55	7.33	7.92	ChEMBL
DP₂	Q56D28	Guinea pig	Prostanoid	A	pIC50	8.52	8.52	8.52	ChEMBL
DP₂	PD2R2	Human	Prostanoid	A	pIC50	7.68	8.16	8.52	ChEMBL
TP	TA2R	Human	Prostanoid	A	pIC50	4.52	4.52	4.52	ChEMBL

Showing 1 to 4 of 4 entries

CHEMBL589973

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.