General Information of the Compound
| Compound ID |
CP0542791
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| Compound Name |
(Z)-8-(2-ethynyl-1,3-thiazol-4-yl)-N-hydroxyoct-7-enamide
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| Structure |
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| Formula |
C13H16N2O2S
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| Molecular Weight |
264.35
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| Canonical SMILES |
ONC(=O)CCCCC\C=C/c1csc(n1)C#C
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| InChI |
InChI=1S/C13H16N2O2S/c1-2-13-14-11(10-18-13)8-6-4-3-5-7-9-12(16)15-17/h1,6,8,10,17H,3-5,7,9H2,(H,15,16)/b8-6-
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| InChIKey |
KAKCYHAHFMDCRW-VURMDHGXSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound
Protein ID: PT00991, Histone deacetylase 1
Protein ID: PT00995, Histone deacetylase 3
Protein ID: PT01213, Histone deacetylase 6
Protein ID: PT01499, Histone deacetylase 8