General Information of the Compound
| Compound ID |
CP0007689
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| Compound Name |
4-[[3-benzyl-5-(4-fluorophenyl)pyrazol-1-yl]methyl]-N-hydroxybenzamide
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| Structure |
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| Formula |
C24H20FN3O2
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| Molecular Weight |
401.441
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| Canonical SMILES |
ONC(=O)c1ccc(Cn2nc(Cc3ccccc3)cc2-c2ccc(F)cc2)cc1
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| InChI |
InChI=1S/C24H20FN3O2/c25-21-12-10-19(11-13-21)23-15-22(14-17-4-2-1-3-5-17)26-28(23)16-18-6-8-20(9-7-18)24(29)27-30/h1-13,15,30H,14,16H2,(H,27,29)
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| InChIKey |
KDVIHOVAOWATMS-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
Protein ID: PT01213, Histone deacetylase 6
Protein ID: PT01499, Histone deacetylase 8