General Information of the Compound
Compound ID |
CP0549076
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Compound Name |
N-(1-(3-(piperidin-1- yl)propyl)-1H- pyrazolo[3,4-d]pyrimidin- 4-yl)pivalamide
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Structure |
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Formula |
C18H28N6O
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Molecular Weight |
344.463
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Canonical SMILES |
CC(C)(C)C(=O)Nc1ncnc2n(CCCN3CCCCC3)ncc12
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InChI |
InChI=1S/C18H28N6O/c1-18(2,3)17(25)22-15-14-12-21-24(16(14)20-13-19-15)11-7-10-23-8-5-4-6-9-23/h12-13H,4-11H2,1-3H3,(H,19,20,22,25)
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InChIKey |
HGCHNGSKVPCVCW-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