General Information of the Compound
| Compound ID |
CP0011048
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| Compound Name |
3-(4-fluorophenyl)-N-[3-(hydroxyamino)-3-oxopropyl]-1H-pyrazole-5-carboxamide
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| Structure |
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| Formula |
C13H13FN4O3
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| Molecular Weight |
292.27
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| Canonical SMILES |
ONC(=O)CCNC(=O)c1cc([nH]n1)-c1ccc(F)cc1
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| InChI |
InChI=1S/C13H13FN4O3/c14-9-3-1-8(2-4-9)10-7-11(17-16-10)13(20)15-6-5-12(19)18-21/h1-4,7,21H,5-6H2,(H,15,20)(H,16,17)(H,18,19)
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| InChIKey |
VENVNABVJGXCEW-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