General Information of the Compound
| Compound ID |
CP0546602
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| Compound Name |
[4-(hydroxycarbamoyl)phenyl]methyl 4-(2-oxo-3,3-diphenylazetidin-1-yl)piperidine-1-carboxylate
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| Structure |
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| Formula |
C29H29N3O5
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| Molecular Weight |
499.567
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| Canonical SMILES |
ONC(=O)c1ccc(COC(=O)N2CCC(CC2)N2CC(C2=O)(c2ccccc2)c2ccccc2)cc1
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| InChI |
InChI=1S/C29H29N3O5/c33-26(30-36)22-13-11-21(12-14-22)19-37-28(35)31-17-15-25(16-18-31)32-20-29(27(32)34,23-7-3-1-4-8-23)24-9-5-2-6-10-24/h1-14,25,36H,15-20H2,(H,30,33)
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| InChIKey |
NNGWSDOSGXOCJL-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