MetaADEDB 2.0 @ LMMD
sematilide
(KHYPYQZQJSBPIX-UHFFFAOYSA-N)
Structure
SMILES
CCN(CCNC(=O)c1ccc(cc1)NS(=O)(=O)C)CC
Molecular Formula:
C14H23N3O3S
Molecular Weight:
313.416
Log P:
2.6744
Hydrogen Bond Acceptor:
6
Hydrogen Bond Donor:
2
TPSA:
86.89
CAS Number(s):
101526-83-4
Synonym(s)
1.
sematilide
2.
CK 1752
3.
CK-1752
External Link(s)
MeSHC062818
PubChem Compound58505
BindingDB50228547
CHEMBLCHEMBL95804
ZINC4194761
Adverse Drug Event(s)
NameNumber of ReportsReference(s)Data Source
1Long QT Syndrome12197602CTD
2Torsades de Pointes1731461
12046984
12197602
CTD
Powered by :

Page last updated at 2020-05-25 10:01:57 (Asia/Shanghai) | You are visitor No. 120265

Copyright © 2019-2020 Laboratory of Molecular Modeling and Design, Shanghai Key Laboratory of New Drug Design, School of Pharmacy, East China University of Science and Technology. All rights reserved.