NEBIVOLOL

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Search structure


Synonyms	Hypoloc Narbivolol Nebilet Nebivolol R-65824 R65,824
Status
Molecule Category	Free-form
ATC	C07AB12
UNII	030Y90569U
EPA CompTox	DTXSID9040556

Structure


InChI Key	KOHIRBRYDXPAMZ-UHFFFAOYSA-N
Smiles	OC(CNCC(O)C1CCc2cc(F)ccc2O1)C1CCc2cc(F)ccc2O1
InChI	InChI=1S/C22H25F2NO4/c23-15-3-7-19-13(9-15)1-5-21(28-19)17(26)11-25-12-18(27)22-6-2-14-10-16(24)4-8-20(14)29-22/h3-4,7-10,17-18,21-22,25-27H,1-2,5-6,11-12H2

Physicochemical Descriptors

Property Name	Value
Molecular Formula	C22H25F2NO4
Molecular Weight	405.44
AlogP	2.36
Hydrogen Bond Acceptor	5.0
Hydrogen Bond Donor	3.0
Number of Rotational Bond	6.0
Polar Surface Area	70.95
Molecular species	BASE
Aromatic Rings	2.0
Heavy Atoms	29.0

Pharmacology

Targets	EC50(nM)	IC50(nM)	Kd(nM)	Ki(nM)	Inhibition(%)
Ion channel Voltage-gated ion channel Potassium channels Voltage-gated potassium channel	-	316.23	-	-	-

Cross References

Resources	Reference
ChEBI	64019
ChEMBL	CHEMBL434394
DrugBank	DB04861
DrugCentral	1887
FDA SRS	030Y90569U
Human Metabolome Database	HMDB0015594
Guide to Pharmacology	7246
PharmGKB	PA151958426
SureChEMBL	SCHEMBL19863

CONTENTS

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