General Information of the Compound
| Compound ID |
CP0945594
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| Compound Name |
4-(1-isopropyl-1H-pyrazol-4-yl)-1-(2-(piperidin-1-yl)ethyl)-1H-pyrazolo[3,4-d]pyrimidine
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| Structure |
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| Formula |
C18H25N7
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| Molecular Weight |
339.447
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| Canonical SMILES |
CC(C)n1cc(-c2ncnc3c2cnn3CCN2CCCCC2)cn1
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| InChI |
InChI=1S/C18H25N7/c1-14(2)25-12-15(10-21-25)17-16-11-22-24(18(16)20-13-19-17)9-8-23-6-4-3-5-7-23/h10-14H,3-9H2,1-2H3
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| InChIKey |
LDFKBHVAEPBLRV-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