General Information of the Compound
| Compound ID |
CP0568560
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| Compound Name |
3-[(4-benzhydrylpiperazin-1-yl)methyl]-N-hydroxybenzamide
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| Structure |
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| Formula |
C25H27N3O2
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| Molecular Weight |
401.51
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| Canonical SMILES |
ONC(=O)c1cccc(CN2CCN(CC2)C(c2ccccc2)c2ccccc2)c1
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| InChI |
InChI=1S/C25H27N3O2/c29-25(26-30)23-13-7-8-20(18-23)19-27-14-16-28(17-15-27)24(21-9-3-1-4-10-21)22-11-5-2-6-12-22/h1-13,18,24,30H,14-17,19H2,(H,26,29)
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| InChIKey |
AXOOZPHQPAOTFP-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: PT03064, Histone deacetylase 6