Amdoxovir
[(2R,4R)-4-(2,6-diaminopurin-9-yl)-1,3-dioxolan-2-yl]methanol
Molecular Identity
Amdoxovir
[(2R,4R)-4-(2,6-diaminopurin-9-yl)-1,3-dioxolan-2-yl]methanol
PubChem CID: 124088
2D Structure
Properties
C9H12N6O3
Molecular Formula
252.23
Molecular Weight
g/mol
252.0971
Exact Mass
Da
-1.2
XLogP
Drug-like (Lipinski: < 5)
134
TPSA
Good oral absorption (< 140 A²)
3
H-Bond Donors
8
H-Bond Acceptors
308
Complexity
SMILES
Canonical SMILES
SMILES: C1C(OC(O1)CO)N2C=NC3=C(N=C(N=C32)N)NIsomeric SMILES
SMILES: C1[C@@H](O[C@@H](O1)CO)N2C=NC3=C(N=C(N=C32)N)NSynonyms(20)
AmdoxovirDAPD145514-04-1(-)-DAPD2,6-Diaminopurine dioxolanebeta-D-2,6-Diaminopurine-dioxolane54I81H0M9C1,3-Dioxolane-2-methanol, 4-(2,6-diamino-9H-purin-9-yl)-, (2R,4R)-amdoxovirum4-(2,6-diamino-9H-purin-9-yl)-1,3,-dioxolane-2-methanolRefChem:5569279-(beta-D-1,3-dioxolan-4-yl)2,6-diaminopurine[(2R,4R)-4-(2,6-diaminopurin-9-yl)-1,3-dioxolan-2-yl]methanol(2R,4R)-4-(2,6-Diamino-9H-purin-9-yl)-1,3-dioxolane-2-methanol(2R-cis)-4-(2,6-Diamino-9H-purin-9-yl)-1,3-dioxolane-2-methanol
Data from PubChem (NCBI)
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