EcoDrugPlus


Synonyms	Bunolol, (-)- Bunolol, (s)- Levobunolol
Status
Molecule Category	Free-form
ATC	S01ED03
UNII	G6317AOI7K
EPA CompTox	DTXSID1043833


InChI Key	IXHBTMCLRNMKHZ-LBPRGKRZSA-N
Smiles	CC(C)(C)NC[C@H](O)COc1cccc2c1CCCC2=O
InChI	InChI=1S/C17H25NO3/c1-17(2,3)18-10-12(19)11-21-16-9-5-6-13-14(16)7-4-8-15(13)20/h5-6,9,12,18-19H,4,7-8,10-11H2,1-3H3/t12-/m0/s1

Property Name	Value
Molecular Formula	C17H25NO3
Molecular Weight	291.39
AlogP	2.33
Hydrogen Bond Acceptor	4.0
Hydrogen Bond Donor	2.0
Number of Rotational Bond	5.0
Polar Surface Area	58.56
Molecular species	BASE
Aromatic Rings	1.0
Heavy Atoms	21.0

Resources	Reference
ChEBI	6438
ChEMBL	CHEMBL1201237
DrugBank	DB01210
DrugCentral	431
FDA SRS	G6317AOI7K
Human Metabolome Database	HMDB0015341
Guide to Pharmacology	570
KEGG	C07914
PharmGKB	PA164747027
PubChem	39468
SureChEMBL	SCHEMBL24095
ZINC	ZINC000003830339

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...

This work is licensed under Creative Commons Attribution-ShareAlike 4.0 International License

Last update: Monday, 3 November 2025

LEVOBUNOLOL

Structure

Physicochemical Descriptors

Related Entries

Cross References