General Information of the Compound
| Compound ID |
CP0322656
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| Compound Name |
4-N-[4-[1-cyclopropyl-3-(oxan-4-yl)pyrazol-4-yl]oxypyridin-2-yl]-2-N-(oxan-4-yl)pyridine-2,4-diamine
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| Structure |
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| Formula |
C26H32N6O3
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| Molecular Weight |
476.581
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| Canonical SMILES |
C1CC1n1cc(Oc2ccnc(Nc3ccnc(NC4CCOCC4)c3)c2)c(n1)C1CCOCC1
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| InChI |
InChI=1S/C26H32N6O3/c1-2-21(1)32-17-23(26(31-32)18-5-11-33-12-6-18)35-22-4-10-28-25(16-22)30-20-3-9-27-24(15-20)29-19-7-13-34-14-8-19/h3-4,9-10,15-19,21H,1-2,5-8,11-14H2,(H2,27,28,29,30)
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| InChIKey |
WHBKZHOCVCXTPT-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