General Information of the Compound
| Compound ID |
CP0672779
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| Compound Name |
1-((3,5-dimethoxyphenyl)(3-(1-methyl-1H-pyrazol-4-yl)quinoxalin-6-yl)amino)-3-(methylamino)propan-2-ol hydrochloride
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| Structure |
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| Formula |
C24H29ClN6O3
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| Molecular Weight |
484.988
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| Canonical SMILES |
CNCC(O)CN(c1cc(OC)cc(OC)c1)c1ccc2ncc(-c3cnn(C)c3)nc2c1.Cl
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| InChI |
InChI=1S/C24H28N6O3.ClH/c1-25-12-19(31)15-30(18-7-20(32-3)10-21(8-18)33-4)17-5-6-22-23(9-17)28-24(13-26-22)16-11-27-29(2)14-16;/h5-11,13-14,19,25,31H,12,15H2,1-4H3;1H
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| InChIKey |
VGBVCGQFMOSJMS-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