General Information of the Compound
| Compound ID |
CP0413073
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| Compound Name |
(E)-3-[3-[3-[(dimethylamino)methyl]indol-1-yl]sulfonylphenyl]-N-hydroxyprop-2-enamide
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| Structure |
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| Formula |
C20H21N3O4S
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| Molecular Weight |
399.472
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| Canonical SMILES |
CN(C)Cc1cn(c2ccccc12)S(=O)(=O)c1cccc(\C=C\C(=O)NO)c1
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| InChI |
InChI=1S/C20H21N3O4S/c1-22(2)13-16-14-23(19-9-4-3-8-18(16)19)28(26,27)17-7-5-6-15(12-17)10-11-20(24)21-25/h3-12,14,25H,13H2,1-2H3,(H,21,24)/b11-10+
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| InChIKey |
FFJUVYLRUBETEY-ZHACJKMWSA-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: PT01213, Histone deacetylase 6
Cell Viability or Cytotoxicity Assay