General Information of the Compound
Compound ID |
CP0416216
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Compound Name |
N-hydroxy-8-[6-(6-methoxypyridin-3-yl)-4-methylquinazolin-8-yl]oxyoctanamide
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Structure |
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Formula |
C23H28N4O4
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Molecular Weight |
424.501
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Canonical SMILES |
COc1ccc(cn1)-c1cc(OCCCCCCCC(=O)NO)c2ncnc(C)c2c1
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InChI |
InChI=1S/C23H28N4O4/c1-16-19-12-18(17-9-10-22(30-2)24-14-17)13-20(23(19)26-15-25-16)31-11-7-5-3-4-6-8-21(28)27-29/h9-10,12-15,29H,3-8,11H2,1-2H3,(H,27,28)
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InChIKey |
JKHMRKPCVNYDNU-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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ChEMBL ID |
Map of Molecular Bioactivity Related to the Compound
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