General Information of the Compound
| Compound ID |
CP0537583
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| Compound Name |
N-hydroxy-2-[4-[(E)-2-[4-[4-(3,4,5-trimethoxybenzoyl)-1,3-thiazol-2-yl]phenoxy]ethenyl]phenyl]acetamide
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| Structure |
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| Formula |
C29H26N2O7S
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| Molecular Weight |
546.601
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| Canonical SMILES |
COc1cc(cc(OC)c1OC)C(=O)c1csc(n1)-c1ccc(O\C=C\c2ccc(CC(=O)NO)cc2)cc1
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| InChI |
InChI=1S/C29H26N2O7S/c1-35-24-15-21(16-25(36-2)28(24)37-3)27(33)23-17-39-29(30-23)20-8-10-22(11-9-20)38-13-12-18-4-6-19(7-5-18)14-26(32)31-34/h4-13,15-17,34H,14H2,1-3H3,(H,31,32)/b13-12+
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| InChIKey |
RWESWSXTEMTXOL-OUKQBFOZSA-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: PT01213, Histone deacetylase 6
Protein ID: PT01499, Histone deacetylase 8