General Information of the Compound
| Compound ID |
CP0438214
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| Compound Name |
US9056843, 57
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| Structure |
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| Formula |
C15H14F3N3O3
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| Molecular Weight |
341.289
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| Canonical SMILES |
FC(F)(F)c1nc(no1)-c1ccc(cc1)C(=O)NC1CCOCC1
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| InChI |
InChI=1S/C15H14F3N3O3/c16-15(17,18)14-20-12(21-24-14)9-1-3-10(4-2-9)13(22)19-11-5-7-23-8-6-11/h1-4,11H,5-8H2,(H,19,22)
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| InChIKey |
WFAMAZWNHSUPHS-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: PT00994, Histone deacetylase 4
Protein ID: PT01213, Histone deacetylase 6