lifirafenib   Click here for help

GtoPdb Ligand ID: 8958

Synonyms: BGB-283 | compound 2.2b [2]
PDB Ligand
Compound class: Synthetic organic
Comment: Lifirafenib (BGB-283) is an investigational inhibitor of the Raf kinases (ARAF, BRAF, CRAF) and the epidermal growth factor receptor (EGFR) tyrosine kinase [1]. BGB-283 is being investigated for its antineoplastic activity. The compound is one of the structures described in patent WO2013097224 A1 [2].
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 4
Hydrogen bond donors 2
Rotatable bonds 4
Topological polar surface area 89.13
Molecular weight 478.13
XLogP 3.33
No. Lipinski's rules broken 0
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Canonical SMILES O=C1CCc2c(N1)nccc2Oc1ccc2c(c1)C1C(O2)C1c1nc2c([nH]1)cc(cc2)C(F)(F)F
Isomeric SMILES O=C1CCc2c(N1)nccc2Oc1ccc2c(c1)[C@@H]1[C@H](O2)[C@H]1c1nc2c([nH]1)cc(cc2)C(F)(F)F
InChI InChI=1S/C25H17F3N4O3/c26-25(27,28)11-1-4-15-16(9-11)31-24(30-15)21-20-14-10-12(2-5-17(14)35-22(20)21)34-18-7-8-29-23-13(18)3-6-19(33)32-23/h1-2,4-5,7-10,20-22H,3,6H2,(H,30,31)(H,29,32,33)/t20-,21-,22-/m0/s1
Classification Click here for help
Compound class Synthetic organic
IUPAC Name Click here for help
International Nonproprietary Names Click here for help
INN number INN
10554 lifirafenib
Synonyms Click here for help
BGB-283 | compound 2.2b [2]
Database Links Click here for help
Specialist databases
Reactome Drug Reactome logo R-ALL-9657033
Reactome Reaction Reactome logo R-HSA-6802938
Other databases
GtoPdb PubChem SID 310264739
PubChem CID 89670174
RCSB PDB Ligand 3K3
Search Google for chemical match using the InChIKey NGFFVZQXSRKHBM-FKBYEOEOSA-N
Search Google for chemicals with the same backbone NGFFVZQXSRKHBM
Search PubMed clinical trials lifirafenib
Search PubMed titles lifirafenib
Search PubMed titles/abstracts lifirafenib
SynPHARM 83246 (in complex with B-Raf proto-oncogene, serine/threonine kinase)
UniChem Compound Search for chemical match using the InChIKey NGFFVZQXSRKHBM-FKBYEOEOSA-N
UniChem Connectivity Search for chemical match using the InChIKey NGFFVZQXSRKHBM-FKBYEOEOSA-N