General Information of the Compound
| Compound ID |
CP0483797
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| Compound Name |
US9056843, 134
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| Structure |
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| Formula |
C19H25F3N4O2
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| Molecular Weight |
398.429
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| Canonical SMILES |
CCN(CC)C[C@H](NC(=O)c1ccc(cc1)-c1noc(n1)C(F)(F)F)C(C)C
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| InChI |
InChI=1S/C19H25F3N4O2/c1-5-26(6-2)11-15(12(3)4)23-17(27)14-9-7-13(8-10-14)16-24-18(28-25-16)19(20,21)22/h7-10,12,15H,5-6,11H2,1-4H3,(H,23,27)/t15-/m0/s1
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| InChIKey |
XWILVJLRPDEIMI-HNNXBMFYSA-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