General Information of the Compound
| Compound ID |
CP0571906
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| Compound Name |
(E)-N-(2-aminophenyl)-3-[2-(3-methoxyphenyl)-1,3-thiazol-5-yl]prop-2-enamide
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| Structure |
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| Formula |
C19H17N3O2S
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| Molecular Weight |
351.431
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| Canonical SMILES |
COc1cccc(c1)-c1ncc(\C=C\C(=O)Nc2ccccc2N)s1
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| InChI |
InChI=1S/C19H17N3O2S/c1-24-14-6-4-5-13(11-14)19-21-12-15(25-19)9-10-18(23)22-17-8-3-2-7-16(17)20/h2-12H,20H2,1H3,(H,22,23)/b10-9+
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| InChIKey |
GAVSXVWVXMCZJI-MDZDMXLPSA-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