ArrestinDb

ICI 118551

Agent/drug
Bioactivity

ICI 118551

SMILES	Cc1ccc(OC[C@@H](O)[C@H](C)NC(C)C)c2c1CCC2
InChIKey	VFIDUCMKNJIJTO-XJKSGUPXSA-N

Chemical Properties

Hydrogen bond acceptors	3
Hydrogen bond donors	2
Rotatable bonds	6
Molecular weight (Da)	277.2

Database connections

PubChem Guide To Pharmacology ChEMBL_compound_ids ChEMBL_compound_ids PubChem GPCRdb
Structure pdb	6PS4 3NY8

Bioactivities

Affinity
Potency

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

β₁	ADRB1	Human	Adrenoceptors	A	pKd	6.74	6.74	6.74	ChEMBL
β₂	ADRB2	Human	Adrenoceptors	A	pKi	9.20	9.35	9.50	Guide to Pharmacology
β₂	ADRB2	Human	Adrenoceptors	A	pKd	6.20	8.44	9.61	ChEMBL
β₃	ADRB3	Human	Adrenoceptors	A	pKi	5.80	6.20	6.60	Guide to Pharmacology

Showing 1 to 4 of 4 entries

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

β₂	ADRB2	Human	Adrenoceptors	A	pIC50	9.13	9.13	9.13	ChEMBL
TSH	TSHR	Human	Glycoprotein hormone	A	Potency	4.40	4.40	4.40	ChEMBL

Showing 1 to 2 of 2 entries

ICI 118551

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

PubChem Guide To Pharmacology ChEMBL_compound_ids ChEMBL_compound_ids PubChem GPCRdb
Structure pdb	6PS4 3NY8

Compound is not listed as a drug.