General Information of the Compound
| Compound ID |
CP0014885
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| Compound Name |
N'-hydroxy-2-(3-imidazo[1,2-a]pyridin-2-ylphenyl)-3H-benzimidazole-5-carboximidamide
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| Formula |
C21H16N6O
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| Molecular Weight |
368.4
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| Canonical SMILES |
ONC(=N)c1ccc2nc([nH]c2c1)-c1cccc(c1)-c1cn2ccccc2n1
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| InChI |
InChI=1S/C21H16N6O/c22-20(26-28)14-7-8-16-17(11-14)25-21(24-16)15-5-3-4-13(10-15)18-12-27-9-2-1-6-19(27)23-18/h1-12,28H,(H2,22,26)(H,24,25)
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| InChIKey |
WEMGUFBETKXSRV-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: PT00994, Histone deacetylase 4
Protein ID: PT00996, Histone deacetylase 5
Protein ID: PT01807, Histone deacetylase 7
Protein ID: PT01946, Histone deacetylase 9