General Information of the Compound
| Compound ID |
CP0701274
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| Compound Name |
2-(3,5-dimethoxy-N-[7-[1-(trideuteriomethyl)pyrazol-4-yl]quinoxalin-2-yl]anilino)ethanol
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| Structure |
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| Formula |
C22H23N5O3
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| Molecular Weight |
408.4763053
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| Canonical SMILES |
[2H]C([2H])([2H])n1cc(-c2ccc3ncc(N(CCO)c4cc(OC)cc(OC)c4)nc3c2)cn1
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| InChI |
InChI=1S/C22H23N5O3/c1-26-14-16(12-24-26)15-4-5-20-21(8-15)25-22(13-23-20)27(6-7-28)17-9-18(29-2)11-19(10-17)30-3/h4-5,8-14,28H,6-7H2,1-3H3/i1D3
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| InChIKey |
XBRAGXSHNWCDEC-FIBGUPNXSA-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