General Information of the Compound
| Compound ID |
CP0438639
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| Compound Name |
N-hydroxy-4-[[3-[2-(4-methoxyphenyl)ethyl]-2,4-dioxoquinazolin-1-yl]methyl]benzamide
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| Structure |
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| Formula |
C25H23N3O5
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| Molecular Weight |
445.475
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| Canonical SMILES |
COc1ccc(CCn2c(=O)n(Cc3ccc(cc3)C(=O)NO)c3ccccc3c2=O)cc1
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| InChI |
InChI=1S/C25H23N3O5/c1-33-20-12-8-17(9-13-20)14-15-27-24(30)21-4-2-3-5-22(21)28(25(27)31)16-18-6-10-19(11-7-18)23(29)26-32/h2-13,32H,14-16H2,1H3,(H,26,29)
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| InChIKey |
BRPFEMHATQFLIK-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: PT02410, Histone deacetylase 11
Protein ID: PT01213, Histone deacetylase 6
Protein ID: PT01499, Histone deacetylase 8