General Information of the Compound
| Compound ID |
CP0949306
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| Compound Name |
4-(6-methoxypyridin-3-yl)-1-(2-(piperidin-1-yl)ethyl)-1H-pyrazolo[3,4-d]pyrimidine
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| Structure |
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| Formula |
C18H22N6O
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| Molecular Weight |
338.415
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| Canonical SMILES |
COc1ccc(-c2ncnc3c2cnn3CCN2CCCCC2)cn1
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| InChI |
InChI=1S/C18H22N6O/c1-25-16-6-5-14(11-19-16)17-15-12-22-24(18(15)21-13-20-17)10-9-23-7-3-2-4-8-23/h5-6,11-13H,2-4,7-10H2,1H3
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| InChIKey |
RROPYJPWANRURB-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