Molecular Identity
pemoline
2-amino-5-phenyl-1,3-oxazol-4-one
PubChem CID: 4723
Pemoline is a member of the class of 1,3-oxazoles that is 1,3-oxazol-4(5H)-one which is substituted by an amino group at position 2 and by a phenyl group at position 5. A central nervous system stimulant, it was used to treat hyperactivity disorders in children, but withdrawn from use following reports of serious hepatotoxicity. It has a role as a central nervous system stimulant.
2D Structure
Properties
C9H8N2O2
Molecular Formula
176.17
Molecular Weight
g/mol
176.0586
Exact Mass
Da
0.9
XLogP
Drug-like (Lipinski: < 5)
64.7
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
2
H-Bond Acceptors
244
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(20)
pemolinePhenoxazoleAzoksodonPhenylisohydantoinTradonAzoxodonDantrominFenoxazolCylertAzoxodoneCentraminPemolinHytonDeltamineKethamed
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to pemoline
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