Valiloxybate
4-[(2S)-2-amino-3-methylbutanoyl]oxybutanoic acid
Molecular Identity
Valiloxybate
4-[(2S)-2-amino-3-methylbutanoyl]oxybutanoic acid
PubChem CID: 54274194
2D Structure
Properties
C9H17NO4
Molecular Formula
203.24
Molecular Weight
g/mol
203.1158
Exact Mass
Da
-1.9
XLogP
Drug-like (Lipinski: < 5)
89.6
TPSA
Good oral absorption (< 140 A²)
2
H-Bond Donors
5
H-Bond Acceptors
203
Complexity
SMILES
Canonical SMILES
SMILES: CC(C)C(C(=O)OCCCC(=O)O)NIsomeric SMILES
SMILES: CC(C)[C@@H](C(=O)OCCCC(=O)O)NSynonyms(20)
4-((L-Valyl)oxy)butanoic acidVALILOXYBATEXWL-008XW101729B8NWP8K91L-Valine, 3-carboxypropyl esterXW-10172RefChem:1100924Valiloxibic acid238401-16-6Valiloxybate [USAN]4-[(2S)-2-amino-3-methylbutanoyl]oxybutanoic acidValiloxybate (USAN)starbld0003028VALILOXYBATE [INN]
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to Valiloxybate
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