General Information of the Compound
| Compound ID |
CP0701261
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| Compound Name |
3-((cyclopropylmethyl)(3-(1-methyl-1H-pyrazol-4-yl)quinoxalin-6-yl)amino)benzonitrile
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| Structure |
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| Formula |
C23H20N6
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| Molecular Weight |
380.455
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| Canonical SMILES |
Cn1cc(-c2cnc3ccc(N(CC4CC4)c4cccc(C#N)c4)cc3n2)cn1
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| InChI |
InChI=1S/C23H20N6/c1-28-15-18(12-26-28)23-13-25-21-8-7-20(10-22(21)27-23)29(14-16-5-6-16)19-4-2-3-17(9-19)11-24/h2-4,7-10,12-13,15-16H,5-6,14H2,1H3
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| InChIKey |
LDCGBICMQUGNFW-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