General Information of the Compound
| Compound ID |
CP0574912
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| Compound Name |
4-[2-(3-chlorophenyl)-4-oxoazetidin-1-yl]-N-[[4-(hydroxycarbamoyl)phenyl]methyl]piperidine-1-carboxamide
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| Structure |
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| Formula |
C23H25ClN4O4
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| Molecular Weight |
456.93
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| Canonical SMILES |
ONC(=O)c1ccc(CNC(=O)N2CCC(CC2)N2C(CC2=O)c2cccc(Cl)c2)cc1
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| InChI |
InChI=1S/C23H25ClN4O4/c24-18-3-1-2-17(12-18)20-13-21(29)28(20)19-8-10-27(11-9-19)23(31)25-14-15-4-6-16(7-5-15)22(30)26-32/h1-7,12,19-20,32H,8-11,13-14H2,(H,25,31)(H,26,30)
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| InChIKey |
QUZUWQSKIBQGSL-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: PT01213, Histone deacetylase 6