Molecules/[[(2r)-1-(6-Aminopurin-9-Yl)propan-2-Yl]oxymethyl-Sulfanyl-Phosphoryl] Phosphono Hydrogen Phosphate
[[(2r)-1-(6-Aminopurin-9-Yl)propan-2-Yl]oxymethyl-Sulfanyl-Phosphoryl] Phosphono Hydrogen Phosphate
[[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-hydroxyphosphinothioyl] phosphono hydrogen phosphate
Molecular Identity
[[(2r)-1-(6-Aminopurin-9-Yl)propan-2-Yl]oxymethyl-Sulfanyl-Phosphoryl] Phosphono Hydrogen Phosphate
[[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-hydroxyphosphinothioyl] phosphono hydrogen phosphate
PubChem CID: 56663461
2D Structure
Properties
C9H16N5O9P3S
Molecular Formula
463.24
Molecular Weight
g/mol
462.9882
Exact Mass
Da
-2.1
XLogP
Drug-like (Lipinski: < 5)
244
TPSA
May have limited oral absorption
5
H-Bond Donors
14
H-Bond Acceptors
667
Complexity
SMILES
Canonical SMILES
SMILES: CC(CN1C=NC2=C(N=CN=C21)N)OCP(=S)(O)OP(=O)(O)OP(=O)(O)OIsomeric SMILES
SMILES: C[C@H](CN1C=NC2=C(N=CN=C21)N)OCP(=S)(O)OP(=O)(O)OP(=O)(O)OSynonyms(6)
[[(2r)-1-(6-Aminopurin-9-Yl)propan-2-Yl]oxymethyl-Sulfanyl-Phosphoryl] Phosphono Hydrogen PhosphateEOIS-PMPAppCHEMBL1852150SCHEMBL13394187[[(1R)-2-(6-aminopurin-9-yl)-1-methyl-ethoxy]methyl-sulfanyl-phosphoryl] phosphono hydrogen phosphate
Data from PubChem (NCBI)
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Molecular Structure
[[(2r)-1-(6-Aminopurin-9-Yl)propan-2-Yl]oxymethyl-Sulfanyl-Phosphoryl] Phosphono Hydrogen Phosphate
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Drug Network
Trials and conditions connected to [[(2r)-1-(6-Aminopurin-9-Yl)propan-2-Yl]oxymethyl-Sulfanyl-Phosphoryl] Phosphono Hydrogen Phosphate
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