MetaADEDB 2.0 @ LMMD
deacylketoconazole
(LOUXSEJZCPKWAX-URXFXBBRSA-N)
Structure
SMILES
Clc1ccc(c(c1)Cl)[C@]1(OC[C@@H](O1)COc1ccc(cc1)N1CCNCC1)Cn1cncc1
Molecular Formula:
C24H26Cl2N4O3
Molecular Weight:
489.394
Log P:
4.3407
Hydrogen Bond Acceptor:
7
Hydrogen Bond Donor:
1
TPSA:
60.78
CAS Number(s):
67914-61-8
Synonym(s)
1.
deacylketoconazole
2.
R 39 519
3.
R 39519
4.
R-39519
5.
de-N-acetylketoconazole
6.
deacetylated ketoconazole
External Link(s)
MeSHC035996
PubChem Compound12854716
CHEMBLCHEMBL372799
ZINC28568236
Adverse Drug Event(s)
NameNumber of ReportsReference(s)Data Source
1Chemical and Drug Induced Liver Injury17966066CTD
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