General Information of the Compound
| Compound ID |
CP0887316
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| Compound Name |
1-Benzyl-3-tert-butyl-N-(3-(2-oxo-2,3-dihydro-1H-imidazo[4,5-b]pyridin-7-yloxy)phenyl)-1H-pyrazole-5-carboxamide
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| Structure |
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| Formula |
C28H27N5O3
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| Molecular Weight |
481.556
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| Canonical SMILES |
CC(C)(C)c1cc(C(=O)Nc2cccc(Oc3cccc4[nH]c(=O)[nH]c34)c2)n(Cc2ccccc2)n1
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| InChI |
InChI=1S/C28H27N5O3/c1-28(2,3)24-16-22(33(32-24)17-18-9-5-4-6-10-18)26(34)29-19-11-7-12-20(15-19)36-23-14-8-13-21-25(23)31-27(35)30-21/h4-16H,17H2,1-3H3,(H,29,34)(H2,30,31,35)
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| InChIKey |
CVWCSKRVIKNZLI-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