ROVATIRELIN

Search structure
Synonyms:
Status: Phase 3
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: 9DL0X410PY

Structure
InChI Key WTXWDXWZGJGIHV-URBCHYCLSA-N
Smile C[C@@H]1OC(=O)N[C@@H]1C(=O)N[C@@H](Cc1cscn1)C(=O)N1CCC[C@H]1C
InChI
InChI=1S/C16H22N4O4S/c1-9-4-3-5-20(9)15(22)12(6-11-7-25-8-17-11)18-14(21)13-10(2)24-16(23)19-13/h7-10,12-13H,3-6H2,1-2H3,(H,18,21)(H,19,23)/t9-,10+,12+,13+/m1/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C16H22N4O4S
Molecular Weight 366.44
AlogP 0.68
Hydrogen Bond Acceptor 6.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 5.0
Polar Surface Area 100.63
Molecular species NEUTRAL
Aromatic Rings 1.0
Heavy Atoms 25.0

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Cerebellar Ataxia 3 D002524 ClinicalTrials

Cross References

Resources Reference
ChEMBL CHEMBL4297622
DrugBank DB15338
EPA CompTox DTXSID90174385
FDA SRS 9DL0X410PY
PubChem 9951059
SureChEMBL SCHEMBL14306794
CONTENTS