Details of the Drug

General Information of Drug (ID: DMWO3N6)

Drug Name
Indeloxazine
Synonyms Elen; Noin; Indeloxazine hydrochloride; YM-08054
Indication
Disease Entry ICD 11 Status REF
Dementia 6D80-6D86 Approved [1]
Drug Type
Small molecular drug
Structure
3D MOL 2D MOL
#Ro5 Violations (Lipinski): 0 Molecular Weight (mw) 231.29
Logarithm of the Partition Coefficient (xlogp) 1.9
Rotatable Bond Count (rotbonds) 3
Hydrogen Bond Donor Count (hbonddonor) 1
Hydrogen Bond Acceptor Count (hbondacc) 3
Chemical Identifiers
Formula
C14H17NO2
IUPAC Name
2-(3H-inden-4-yloxymethyl)morpholine
Canonical SMILES
C1COC(CN1)COC2=CC=CC3=C2CC=C3
InChI
InChI=1S/C14H17NO2/c1-3-11-4-2-6-14(13(11)5-1)17-10-12-9-15-7-8-16-12/h1-4,6,12,15H,5,7-10H2
InChIKey
MADRVGBADLFHMO-UHFFFAOYSA-N
Cross-matching ID
PubChem CID
3704
ChEBI ID
CHEBI:5894
CAS Number
60929-23-9
TTD ID
D07TGY

Molecular Interaction Atlas of This Drug


Drug Therapeutic Target (DTT)
DTT Name DTT ID UniProt ID MOA REF
Monoamine oxidase type B (MAO-B) TTGP7BY AOFB_HUMAN Modulator [1]
Molecular Interaction Atlas (MIA) Jump to Detail Molecular Interaction Atlas of This Drug

Molecular Expression Atlas of This Drug

The Studied Disease Dementia
ICD Disease Classification 6D80-6D86
Molecule Name Molecule Type Gene Name p-value Fold-Change Z-score
Monoamine oxidase type B (MAO-B) DTT MAOB 2.65E-02 1.12E-02 0.07
Molecular Expression Atlas (MEA) Jump to Detail Molecular Expression Atlas of This Drug

References

1 Drugs@FDA. U.S. Food and Drug Administration. U.S. Department of Health & Human Services. 2015