MetaADEDB 2.0 @ LMMD
darbufelone
(AKTXOQVMWSFEBQ-LCYFTJDESA-N)
Structure
SMILES
CC(c1cc(/C=C/2\SC(=NC2=O)N)cc(c1O)C(C)(C)C)(C)C
Molecular Formula:
C18H24N2O2S
Molecular Weight:
332.460
Log P:
4.0521
Hydrogen Bond Acceptor:
5
Hydrogen Bond Donor:
2
TPSA:
100.98
CAS Number(s):
139226-28-1
Synonym(s)
1.
darbufelone
2.
5-((3,5--bis(1,1-dimethylethyl)-4-hydroxyphenyl)methylene)-2-imino-4-thiazolidinone methanesulfonate
3.
CI 1004
4.
CI-1004
5.
PD0136095-73
6.
darbufelone mesylate
External Link(s)
MeSHC109268
PubChem Compound6444826
135564773
BindingDB50044080
50075517
CHEMBLCHEMBL275835
ZINC3783481
Adverse Drug Event(s)
NameNumber of ReportsReference(s)Data Source
1Lung Neoplasms20352217CTD
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