General Information of the Compound
| Compound ID |
CP0683289
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| Compound Name |
1-((3,5-dimethoxyphenyl)(3-(1-methyl-1H-pyrazol-4-yl)quinoxalin-6-yl)amino)-3-(piperidin-1-yl)propan-2-ol
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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(CC(O)CN2CCCCC2)c2ccc3ncc(-c4cnn(C)c4)nc3c2)c1
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| InChI |
InChI=1S/C28H34N6O3/c1-32-17-20(15-30-32)28-16-29-26-8-7-21(13-27(26)31-28)34(19-23(35)18-33-9-5-4-6-10-33)22-11-24(36-2)14-25(12-22)37-3/h7-8,11-17,23,35H,4-6,9-10,18-19H2,1-3H3
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| InChIKey |
PILVYDBBHFTMOU-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