EcoDrugPlus


Synonyms	Belvarafenib
Status
Molecule Category	Free-form
UNII	31M3WLJ3KG

Synonyms

Belvarafenib

Status

Molecule Category

Free-form

UNII

31M3WLJ3KG


InChI Key	KVCQTKNUUQOELD-UHFFFAOYSA-N
Smiles	Cc1ccc2c(Nc3cccc(Cl)c3F)nccc2c1NC(=O)c1csc2c(N)ncnc12
InChI	InChI=1S/C23H16ClFN6OS/c1-11-5-6-13-12(7-8-27-22(13)30-16-4-2-3-15(24)17(16)25)18(11)31-23(32)14-9-33-20-19(14)28-10-29-21(20)26/h2-10H,1H3,(H,27,30)(H,31,32)(H2,26,28,29)

InChI Key

KVCQTKNUUQOELD-UHFFFAOYSA-N

Smiles

Cc1ccc2c(Nc3cccc(Cl)c3F)nccc2c1NC(=O)c1csc2c(N)ncnc12

InChI

InChI=1S/C23H16ClFN6OS/c1-11-5-6-13-12(7-8-27-22(13)30-16-4-2-3-15(24)17(16)25)18(11)31-23(32)14-9-33-20-19(14)28-10-29-21(20)26/h2-10H,1H3,(H,27,30)(H,31,32)(H2,26,28,29)

Property Name	Value
Molecular Formula	C23H16ClFN6OS
Molecular Weight	478.94
AlogP	5.92
Hydrogen Bond Acceptor	7.0
Hydrogen Bond Donor	3.0
Number of Rotational Bond	4.0
Polar Surface Area	105.82
Molecular species	NEUTRAL
Aromatic Rings	5.0
Heavy Atoms	33.0

Property Name

Value

Molecular Formula

C23H16ClFN6OS

Molecular Weight

478.94

AlogP

5.92

Hydrogen Bond Acceptor

7.0

Hydrogen Bond Donor

3.0

Number of Rotational Bond

4.0

Polar Surface Area

105.82

Molecular species

NEUTRAL

Aromatic Rings

5.0

Heavy Atoms

33.0

Mechanism of Action	Action	Reference
RAF serine/threonine protein kinase inhibitor	INHIBITOR	Other Other

Mechanism of Action

Action

Reference

RAF serine/threonine protein kinase inhibitor

INHIBITOR

Other Other

Resources	Reference
ChEMBL	CHEMBL3977543
FDA SRS	31M3WLJ3KG
PDB	V1Y
SureChEMBL	SCHEMBL15066408

Resources

Reference

ChEMBL

FDA SRS

PDB

SureChEMBL

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

BELVARAFENIB

Structure

Physicochemical Descriptors

Pharmacology

Cross References