General Information of the Compound
| Compound ID |
CP0393177
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| Compound Name |
4-[[butyl(2-pyrrolidin-1-ylethylcarbamoyl)amino]methyl]-N-hydroxybenzamide
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| Structure |
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| Formula |
C19H30N4O3
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| Molecular Weight |
362.474
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| Canonical SMILES |
CCCCN(Cc1ccc(cc1)C(=O)NO)C(=O)NCCN1CCCC1
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| InChI |
InChI=1S/C19H30N4O3/c1-2-3-13-23(19(25)20-10-14-22-11-4-5-12-22)15-16-6-8-17(9-7-16)18(24)21-26/h6-9,26H,2-5,10-15H2,1H3,(H,20,25)(H,21,24)
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| InChIKey |
CXJRCCTWFSBLFQ-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