Encorafenib
methyl N-[(2S)-1-[[4-[3-[5-chloro-2-fluoro-3-(methanesulfonamido)phenyl]-1-propan-2-ylpyrazol-4-yl]pyrimidin-2-yl]amino]propan-2-yl]carbamate
Molecular Identity
Encorafenib
methyl N-[(2S)-1-[[4-[3-[5-chloro-2-fluoro-3-(methanesulfonamido)phenyl]-1-propan-2-ylpyrazol-4-yl]pyrimidin-2-yl]amino]propan-2-yl]carbamate
PubChem CID: 50922675
2D Structure
Properties
C22H27ClFN7O4S
Molecular Formula
540.00
Molecular Weight
g/mol
539.1518
Exact Mass
Da
2.7
XLogP
Drug-like (Lipinski: < 5)
149
TPSA
May have limited oral absorption
3
H-Bond Donors
10
H-Bond Acceptors
836
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(20)
Encorafenib1269440-17-6LGX818LGX-818BraftoviLGX 818NVP-LGX818NVP-LGX818-NXANVP-LGX-818-NXA8L7891MRB6methyl N-[(2S)-1-[[4-[3-[5-chloro-2-fluoro-3-(methanesulfonamido)phenyl]-1-propan-2-ylpyrazol-4-yl]pyrimidin-2-yl]amino]propan-2-yl]carbamateDTXSID00155347Methyl N-[(2S)-1-({4-[3-(5-chloro-2-fluoro-3-methanesulfonamidophenyl)-1-(propan-2-yl)-1H-pyrazol-4-yl]pyrimidin-2-yl}amino)propan-2-yl]carbamateencorafenibummethyl N-((2S)-1-((4-(3-(5-chloro-2-fluoro-3-(methanesulfonamido)phenyl)-1-propan-2-ylpyrazol-4-yl)pyrimidin-2-yl)amino)propan-2-yl)carbamate
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to Encorafenib
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