General Information of the Compound
| Compound ID |
CP0514697
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| Compound Name |
N-(4-(2-pentylhydrazine-1- carbonyl)benzyl)cinnamamide
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| Structure |
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| Formula |
C22H27N3O2
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| Molecular Weight |
365.477
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| Canonical SMILES |
CCCCCNNC(=O)c1ccc(CNC(=O)\C=C\c2ccccc2)cc1
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| InChI |
InChI=1S/C22H27N3O2/c1-2-3-7-16-24-25-22(27)20-13-10-19(11-14-20)17-23-21(26)15-12-18-8-5-4-6-9-18/h4-6,8-15,24H,2-3,7,16-17H2,1H3,(H,23,26)(H,25,27)/b15-12+
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| InChIKey |
BQTCOFJJIMMRQO-NTCAYCPXSA-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: PT00835, Histone deacetylase 2
Protein ID: PT00995, Histone deacetylase 3