General Information of the Compound
| Compound ID |
CP0005117
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| Compound Name |
7-(3,4-dihydro-1H-isoquinolin-2-yl)-N-hydroxyheptanamide
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| Structure |
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| Formula |
C16H24N2O2
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| Molecular Weight |
276.38
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| Canonical SMILES |
ONC(=O)CCCCCCN1CCc2ccccc2C1
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| InChI |
InChI=1S/C16H24N2O2/c19-16(17-20)9-3-1-2-6-11-18-12-10-14-7-4-5-8-15(14)13-18/h4-5,7-8,20H,1-3,6,9-13H2,(H,17,19)
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| InChIKey |
LOEFBHPFPGYXOH-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: PT00835, Histone deacetylase 2