General Information of the Compound
| Compound ID |
CP0524027
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| Compound Name |
5-(4-((2-methoxyethyl)(propyl)amino)-3,6-dimethyl-1H-pyrazolo[3,4-d]pyrimidin-1-yl)-6-methylpicolinamide
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| Structure |
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| Formula |
C20H27N7O2
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| Molecular Weight |
397.483
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| Canonical SMILES |
CCCN(CCOC)c1nc(C)nc2n(nc(C)c12)-c1ccc(nc1C)C(N)=O
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| InChI |
InChI=1S/C20H27N7O2/c1-6-9-26(10-11-29-5)19-17-13(3)25-27(20(17)24-14(4)23-19)16-8-7-15(18(21)28)22-12(16)2/h7-8H,6,9-11H2,1-5H3,(H2,21,28)
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| InChIKey |
KMLRLORZOCMNDO-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