General Information of the Compound
| Compound ID |
CP0427366
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| Compound Name |
2-benzyl-N-hydroxy-N'-phenyloctanediamide
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| Structure |
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| Formula |
C21H26N2O3
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| Molecular Weight |
354.45
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| Canonical SMILES |
ONC(=O)C(CCCCCC(=O)Nc1ccccc1)Cc1ccccc1
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| InChI |
InChI=1S/C21H26N2O3/c24-20(22-19-13-7-3-8-14-19)15-9-2-6-12-18(21(25)23-26)16-17-10-4-1-5-11-17/h1,3-5,7-8,10-11,13-14,18,26H,2,6,9,12,15-16H2,(H,22,24)(H,23,25)
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| InChIKey |
DPPQTBNAWODKHL-UHFFFAOYSA-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