Details of the Drug

General Information of Drug (ID: DMD275X)

Drug Name

Pardoprunox

Synonyms

Pardoprunox (USAN/INN); 7-(4-methylpiperazin-1-yl)-3H-1,3-benzoxazol-2-one; 7-(4-methylpiperazin-1-yl)-3H-benzooxazol-2-one

Indication

Disease Entry	ICD 11	Status	REF
Parkinson disease	8A00.0	Phase 2	[1]
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Drug Type

Small molecular drug

Structure

3D MOL

2D MOL

#Ro5 Violations (Lipinski): 0

Molecular Weight (mw)

233.27

Logarithm of the Partition Coefficient (xlogp)

1.1

Rotatable Bond Count (rotbonds)

1

Hydrogen Bond Donor Count (hbonddonor)

1

Hydrogen Bond Acceptor Count (hbondacc)

4

Chemical Identifiers

Formula: C12H15N3O2
IUPAC Name: 7-(4-methylpiperazin-1-yl)-3H-1,3-benzoxazol-2-one
Canonical SMILES: CN1CCN(CC1)C2=CC=CC3=C2OC(=O)N3
InChI: InChI=1S/C12H15N3O2/c1-14-5-7-15(8-6-14)10-4-2-3-9-11(10)17-12(16)13-9/h2-4H,5-8H2,1H3,(H,13,16)
InChIKey: YVPUUUDAZYFFQT-UHFFFAOYSA-N