General Information of the Compound
Compound ID |
CP0945596
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Compound Name |
2-[1-[2-(piperidin-1-yl)ethyl]-1H-pyrazolo[3,4-d]pyrimidin-4-yl]oxazole
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Structure |
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Formula |
C15H18N6O
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Molecular Weight |
298.35
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Canonical SMILES |
c1coc(-c2ncnc3c2cnn3CCN2CCCCC2)n1
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InChI |
InChI=1S/C15H18N6O/c1-2-5-20(6-3-1)7-8-21-14-12(10-19-21)13(17-11-18-14)15-16-4-9-22-15/h4,9-11H,1-3,5-8H2
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InChIKey |
XXKCIUMSYKWSOE-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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ChEMBL ID |
Map of Molecular Bioactivity Related to the Compound
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