Vociprotafib
[6-[(2-amino-3-chloro-4-pyridinyl)sulfanyl]-3-[(3S,4S)-4-amino-3-methyl-2-oxa-8-azaspiro[4.5]decan-8-yl]-5-methylpyrazin-2-yl]methanol
Molecular Identity
Vociprotafib
[6-[(2-amino-3-chloro-4-pyridinyl)sulfanyl]-3-[(3S,4S)-4-amino-3-methyl-2-oxa-8-azaspiro[4.5]decan-8-yl]-5-methylpyrazin-2-yl]methanol
PubChem CID: 134182831
2D Structure
Properties
C20H27ClN6O2S
Molecular Formula
451.00
Molecular Weight
g/mol
450.1605
Exact Mass
Da
1.2
XLogP
Drug-like (Lipinski: < 5)
149
TPSA
May have limited oral absorption
3
H-Bond Donors
9
H-Bond Acceptors
583
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(20)
VociprotafibRMC-46302172652-48-9RMC4630SAR442720SAR-442720PTPN11 inhibitor RMC-4630SHP2-IN-7Rmc 4630C4YBF9170L[6-(2-Amino-3-chloropyridin-4-yl)sulfanyl-3-[(3S,4S)-4-amino-3-methyl-2-oxa-8-azaspiro[4.5]decan-8-yl]-5-methylpyrazin-2-yl]methanolcompound A-290 [WO2018013597A1]2-Pyrazinemethanol, 6-((2-amino-3-chloro-4-pyridinyl)thio)-3-((3S,4S)-4-amino-3-methyl-2-oxa-8-azaspiro(4.5)dec-8-yl)-5-methyl-2-Pyrazinemethanol, 6-[(2-amino-3-chloro-4-pyridinyl)thio]-3-[(3S,4S)-4-amino-3-methyl-2-oxa-8-azaspiro[4.5]dec-8-yl]-5-methyl-compound A-290 (WO2018013597A1)
Data from PubChem (NCBI)
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