General Information of the Compound
| Compound ID |
CP0945593
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| Compound Name |
4-(2,5-dimethylphenyl)-1-(2-(piperidin-1-yl)ethyl)-1H-pyrazolo[3,4-d]pyrimidine
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| Structure |
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| Formula |
C20H25N5
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| Molecular Weight |
335.455
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| Canonical SMILES |
Cc1ccc(C)c(-c2ncnc3c2cnn3CCN2CCCCC2)c1
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| InChI |
InChI=1S/C20H25N5/c1-15-6-7-16(2)17(12-15)19-18-13-23-25(20(18)22-14-21-19)11-10-24-8-4-3-5-9-24/h6-7,12-14H,3-5,8-11H2,1-2H3
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| InChIKey |
FBJGYYBJLVAXCD-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