General Information of the Compound
| Compound ID |
CP0452406
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| Compound Name |
6-((4,5-dimethyloxazol-2-ylthio)methyl)-N-((6-((2-fluoroethoxy)methyl)pyridin-2-yl)methyl)-4-morpholinopyridin-2-amine
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| Structure |
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| Formula |
C24H30FN5O3S
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| Molecular Weight |
487.601
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| Canonical SMILES |
Cc1nc(SCc2cc(cc(NCc3cccc(COCCF)n3)n2)N2CCOCC2)oc1C
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| InChI |
InChI=1S/C24H30FN5O3S/c1-17-18(2)33-24(27-17)34-16-21-12-22(30-7-10-31-11-8-30)13-23(29-21)26-14-19-4-3-5-20(28-19)15-32-9-6-25/h3-5,12-13H,6-11,14-16H2,1-2H3,(H,26,29)
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| InChIKey |
FMAPVZVODOZYFJ-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