General Information of the Compound
| Compound ID |
CP0424221
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| Compound Name |
4-[[2,4-dioxo-3-[2-[3-(trifluoromethyl)phenyl]ethyl]quinazolin-1-yl]methyl]-N-hydroxybenzamide
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| Structure |
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| Formula |
C25H20F3N3O4
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| Molecular Weight |
483.446
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| Canonical SMILES |
ONC(=O)c1ccc(Cn2c3ccccc3c(=O)n(CCc3cccc(c3)C(F)(F)F)c2=O)cc1
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| InChI |
InChI=1S/C25H20F3N3O4/c26-25(27,28)19-5-3-4-16(14-19)12-13-30-23(33)20-6-1-2-7-21(20)31(24(30)34)15-17-8-10-18(11-9-17)22(32)29-35/h1-11,14,35H,12-13,15H2,(H,29,32)
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| InChIKey |
IVOKPEDWUKQUED-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