General Information of the Compound
| Compound ID |
CP0533518
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| Compound Name |
4-[[2-[(3,4-difluorophenyl)sulfonyl-[[2-(trifluoromethyl)phenyl]methyl]amino]acetyl]-[[4-(trifluoromethyl)phenyl]methyl]amino]-N-hydroxybenzamide
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| Structure |
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| Formula |
C31H23F8N3O5S
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| Molecular Weight |
701.592
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| Canonical SMILES |
ONC(=O)c1ccc(cc1)N(Cc1ccc(cc1)C(F)(F)F)C(=O)CN(Cc1ccccc1C(F)(F)F)S(=O)(=O)c1ccc(F)c(F)c1
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| InChI |
InChI=1S/C31H23F8N3O5S/c32-26-14-13-24(15-27(26)33)48(46,47)41(17-21-3-1-2-4-25(21)31(37,38)39)18-28(43)42(23-11-7-20(8-12-23)29(44)40-45)16-19-5-9-22(10-6-19)30(34,35)36/h1-15,45H,16-18H2,(H,40,44)
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| InChIKey |
MPRCLKOXHHCIRF-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: PT02410, Histone deacetylase 11
Protein ID: PT00995, Histone deacetylase 3
Protein ID: PT01213, Histone deacetylase 6
Protein ID: PT01499, Histone deacetylase 8