General Information of the Compound
| Compound ID |
CP0667757
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| Compound Name |
N-(2,6-dichloro-3,5-dimethoxyphenyl)-N-(3-(3-methoxypyridin-2-yl)prop-2-ynyl)-3-(1-methyl-1H-pyrazol-4-yl)quinoxalin-6-amine
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| Structure |
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| Formula |
C29H24Cl2N6O3
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| Molecular Weight |
575.456
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| Canonical SMILES |
COc1cccnc1C#CCN(c1ccc2ncc(-c3cnn(C)c3)nc2c1)c1c(Cl)c(OC)cc(OC)c1Cl
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| InChI |
InChI=1S/C29H24Cl2N6O3/c1-36-17-18(15-34-36)23-16-33-20-10-9-19(13-22(20)35-23)37(12-6-7-21-24(38-2)8-5-11-32-21)29-27(30)25(39-3)14-26(40-4)28(29)31/h5,8-11,13-17H,12H2,1-4H3
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| InChIKey |
PPFQKJGJQXSDJS-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