General Information of the Compound
| Compound ID |
CP0816363
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| Compound Name |
3-((3,5-dimethoxyphenyl)(3-(1-isopropyl-1H-pyrazol-4-yl)quinoxalin-6-yl)amino)-1,1,1-trifluoropropan-2-ol
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| Structure |
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| Formula |
C25H26F3N5O3
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| Molecular Weight |
501.509
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| Canonical SMILES |
COc1cc(OC)cc(N(CC(O)C(F)(F)F)c2ccc3ncc(-c4cnn(C(C)C)c4)nc3c2)c1
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| InChI |
InChI=1S/C25H26F3N5O3/c1-15(2)33-13-16(11-30-33)23-12-29-21-6-5-17(9-22(21)31-23)32(14-24(34)25(26,27)28)18-7-19(35-3)10-20(8-18)36-4/h5-13,15,24,34H,14H2,1-4H3
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| InChIKey |
JXGGHGLZZYBWNG-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