General Information of the Compound
| Compound ID |
CP0962698
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| Compound Name |
N-methyl-1-(1-(2-(piperidin-1-yl)ethyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl)pyrrolidin-3-amine
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| Structure |
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| Formula |
C17H27N7
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| Molecular Weight |
329.452
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| Canonical SMILES |
CNC1CCN(c2ncnc3c2cnn3CCN2CCCCC2)C1
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| InChI |
InChI=1S/C17H27N7/c1-18-14-5-8-23(12-14)16-15-11-21-24(17(15)20-13-19-16)10-9-22-6-3-2-4-7-22/h11,13-14,18H,2-10,12H2,1H3
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| InChIKey |
NNUAZXFKWVVVLZ-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