ISOPROTERENOL


Synonyms	A-21 Aleudrin Aludrine Asiprenol Asmalar Assiprenol Bellasthman Isonorin Isoprenaline Isopropydrin Isoproterenol Isoproterenol dl-form Isorenin Isupren NSC-33791
Status
Molecule Category	Free-form
UNII	L628TT009W
EPA CompTox	DTXSID4023175


InChI Key	JWZZKOKVBUJMES-UHFFFAOYSA-N
Smiles	CC(C)NCC(O)c1ccc(O)c(O)c1
InChI	InChI=1S/C11H17NO3/c1-7(2)12-6-11(15)8-3-4-9(13)10(14)5-8/h3-5,7,11-15H,6H2,1-2H3

Property Name	Value
Molecular Formula	C11H17NO3
Molecular Weight	211.26
AlogP	1.13
Hydrogen Bond Acceptor	4.0
Hydrogen Bond Donor	4.0
Number of Rotational Bond	4.0
Polar Surface Area	72.72
Molecular species	BASE
Aromatic Rings	1.0
Heavy Atoms	15.0

Targets	EC50(nM)	IC50(nM)	Kd(nM)	Ki(nM)	Inhibition(%)
Membrane receptor Family A G protein-coupled receptor Small molecule receptor (family A GPCR) Monoamine receptor Adrenergic receptor	0.084-980	0.1-600	17.78-740	2.44-676.08	-

	EC50(nM)	IC50(nM)	Kd(nM)	Ki(nM)	Inhibition(%)
Canis lupus familiaris	-	-	-	-	20
Cavia porcellus	1.5-58	150	17.78-25.12	-	49
Homo sapiens	0.084-120	150-370	50-740	2.44-192	-
Mus musculus	19	-	-	220	-
Mustela putorius furo	87-87.1	-	-	-	-
Rattus norvegicus	10-226	0.1	-	-	-

Header

Compound Name

Maximum Phase

Compound Structure

Smile

Inchi

InchiKey

Compound Properties

Molecular Formula

Molecular Weight

ALogP

PSA

Resources	Reference
ChEBI	64317
ChEMBL	CHEMBL434
DrugBank	DB01064
DrugCentral	1499
FDA SRS	L628TT009W
Human Metabolome Database	HMDB0015197
Guide to Pharmacology	536
KEGG	C07056
PharmGKB	PA450121
PubChem	3779
SureChEMBL	SCHEMBL4165

EcoDrug+ was developed under the PREMIER Innovative Medicines Initiative 2 Joint Undertaking (JU) under grant agreement No 875508. The JU receives support from the EU’s Horizon 2020 research and innovation programme and the European Federation of Pharmaceutical Industries and Associations (EFPIA). The views reflect only the authors’ perspective and the JU is not responsible for any use that may be made of the information EcoDrug+ contains.

Elements of EcoDrug+ were developed under the Biocenter Finland Drug Discovery and Chemical Biology network. CSC-IT Center for Science Ltd is thanked for providing computational resources. Credit is given to Ensembl for collecting species images (provided under public domain licences such as Wikimedia and NHGRI).

Content of EcoDrug+ is provided without guarantee for correctness.

Cite Us:

Ashenafi Legehar, Siobhán Monaghan, Mael Briand, Akseli Niemelä, Leo Ghemtio, Ziaurrehman Tanoli, A Ross Brown, Charles R Tyler, Henri Xhaard, EcoDrug PLUS: an advanced database for drug target conservation analysis and environmental risk assessment, Nucleic Acids Research, 2025, gkaf1251 Read...

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Last update: Monday, 3 November 2025

ISOPROTERENOL

Structure

Physicochemical Descriptors

Pharmacology

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