General Information of the Compound
| Compound ID |
CP0692271
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| Compound Name |
N-(3,5-dimethoxyphenyl)-N-((3-((isopropylamino)methyl)oxetan-3-yl)methyl)-3-(1-methyl-1H-pyrazol-4-yl)quinoxalin-6-amine
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| Structure |
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| Formula |
C28H34N6O3
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| Molecular Weight |
502.619
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| Canonical SMILES |
COc1cc(OC)cc(N(CC2(CNC(C)C)COC2)c2ccc3ncc(-c4cnn(C)c4)nc3c2)c1
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| InChI |
InChI=1S/C28H34N6O3/c1-19(2)30-15-28(17-37-18-28)16-34(22-8-23(35-4)11-24(9-22)36-5)21-6-7-25-26(10-21)32-27(13-29-25)20-12-31-33(3)14-20/h6-14,19,30H,15-18H2,1-5H3
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| InChIKey |
FIOAXDHVMFVFQO-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