General Information of the Compound
| Compound ID |
CP0531232
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| Compound Name |
N-hydroxy-4-[[2-oxo-4-phenyl-1-(pyridin-4-ylmethyl)quinolin-3-yl]oxymethyl]benzamide
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| Formula |
C29H23N3O4
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| Molecular Weight |
477.52
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| Canonical SMILES |
ONC(=O)c1ccc(COc2c(-c3ccccc3)c3ccccc3n(Cc3ccncc3)c2=O)cc1
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| InChI |
InChI=1S/C29H23N3O4/c33-28(31-35)23-12-10-21(11-13-23)19-36-27-26(22-6-2-1-3-7-22)24-8-4-5-9-25(24)32(29(27)34)18-20-14-16-30-17-15-20/h1-17,35H,18-19H2,(H,31,33)
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| InChIKey |
HKCWVAXKRQUQGW-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