tucidinostat   Click here for help

GtoPdb Ligand ID: 8305

Synonyms: chidamide | CS-055 | CS055 | HBI-8000
Approved drug
tucidinostat is an approved drug (China)
Compound class: Synthetic organic
Comment: Tucidinostat (chidamide) is an orally active inhibitor of histone deacetylase (HDAC) enzymes [4]. It has some subtype selectivity for HDAC isoenzymes 1, 2, 3 and 10. Note that we show this compound with no specified stereochemistry.
2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 6
Hydrogen bond donors 3
Rotatable bonds 8
Topological polar surface area 97.11
Molecular weight 390.15
XLogP 2.47
No. Lipinski's rules broken 0
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Canonical SMILES O=C(C=Cc1cccnc1)NCc1ccc(cc1)C(=O)Nc1cc(F)ccc1N
Isomeric SMILES O=C(C=Cc1cccnc1)NCc1ccc(cc1)C(=O)Nc1cc(F)ccc1N
InChI InChI=1S/C22H19FN4O2/c23-18-8-9-19(24)20(12-18)27-22(29)17-6-3-16(4-7-17)14-26-21(28)10-5-15-2-1-11-25-13-15/h1-13H,14,24H2,(H,26,28)(H,27,29)
Classification Click here for help
Compound class Synthetic organic
Approved drug? Yes (China)
IUPAC Name Click here for help
International Nonproprietary Names Click here for help
INN number INN
10318 tucidinostat
Synonyms Click here for help
chidamide | CS-055 | CS055 | HBI-8000
Database Links Click here for help
CAS Registry No. 743420-02-2
GtoPdb PubChem SID 252166517
PubChem CID 53394037
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