General Information of the Compound
| Compound ID |
CP0535180
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| Compound Name |
N'-hydroxy-N-[6-(3-methoxyphenyl)-1H-indazol-3-yl]heptanediamide
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| Formula |
C21H24N4O4
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| Molecular Weight |
396.447
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| Canonical SMILES |
COc1cccc(c1)-c1ccc2c(NC(=O)CCCCCC(=O)NO)n[nH]c2c1
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| InChI |
InChI=1S/C21H24N4O4/c1-29-16-7-5-6-14(12-16)15-10-11-17-18(13-15)23-24-21(17)22-19(26)8-3-2-4-9-20(27)25-28/h5-7,10-13,28H,2-4,8-9H2,1H3,(H,25,27)(H2,22,23,24,26)
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| InChIKey |
LERLFDFPFJEQDF-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: PT01499, Histone deacetylase 8