General Information of the Compound
| Compound ID |
CP0955815
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| Compound Name |
7-(5-(((2-ethyl-4-morpholinoquinolin-7-yl)oxy)methyl)pyridin-3-yl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine
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| Structure |
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| Formula |
C27H27N7O2
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| Molecular Weight |
481.56
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| Canonical SMILES |
CCc1cc(N2CCOCC2)c2ccc(OCc3cncc(-n4ccc5c(N)ncnc54)c3)cc2n1
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| InChI |
InChI=1S/C27H27N7O2/c1-2-19-12-25(33-7-9-35-10-8-33)22-4-3-21(13-24(22)32-19)36-16-18-11-20(15-29-14-18)34-6-5-23-26(28)30-17-31-27(23)34/h3-6,11-15,17H,2,7-10,16H2,1H3,(H2,28,30,31)
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| InChIKey |
YLOZWGRXWJXLGC-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