General Information of the Compound
| Compound ID |
CP0577328
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| Compound Name |
4-[[[2-(cyclohexylamino)-2-oxoethyl]-[2-(trifluoromethyl)benzoyl]amino]methyl]-3-fluoro-N-hydroxybenzamide
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| Structure |
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| Formula |
C24H25F4N3O4
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| Molecular Weight |
495.473
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| Canonical SMILES |
ONC(=O)c1ccc(CN(CC(=O)NC2CCCCC2)C(=O)c2ccccc2C(F)(F)F)c(F)c1
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| InChI |
InChI=1S/C24H25F4N3O4/c25-20-12-15(22(33)30-35)10-11-16(20)13-31(14-21(32)29-17-6-2-1-3-7-17)23(34)18-8-4-5-9-19(18)24(26,27)28/h4-5,8-12,17,35H,1-3,6-7,13-14H2,(H,29,32)(H,30,33)
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| InChIKey |
JBQWLEPVSMBVRS-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