General Information of the Compound
| Compound ID |
CP0702437
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| Compound Name |
3-fluoro-5-((2-hydroxyethyl)(3-(1-methyl-1H-pyrazol-4-yl)quinoxalin-6-yl)amino)-N-methylbenzamide
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| Structure |
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| Formula |
C22H21FN6O2
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| Molecular Weight |
420.448
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| Canonical SMILES |
CNC(=O)c1cc(F)cc(N(CCO)c2ccc3ncc(-c4cnn(C)c4)nc3c2)c1
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| InChI |
InChI=1S/C22H21FN6O2/c1-24-22(31)14-7-16(23)9-18(8-14)29(5-6-30)17-3-4-19-20(10-17)27-21(12-25-19)15-11-26-28(2)13-15/h3-4,7-13,30H,5-6H2,1-2H3,(H,24,31)
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| InChIKey |
CAMOGMXHVRSGKE-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: PT01091, Fibroblast growth factor receptor 1
Protein ID: PT01411, Fibroblast growth factor receptor 3
Protein ID: PT01204, Receptor-type tyrosine-protein kinase FLT3
Protein ID: PT00864, Vascular endothelial growth factor receptor 2