General Information of the Compound
| Compound ID |
CP0423673
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| Compound Name |
N-(1-acetylpiperidin-4-yl)-1-ethyl-4-(oxan-4-ylamino)pyrazolo[3,4-b]pyridine-5-carboxamide
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| Structure |
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| Formula |
C21H30N6O3
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| Molecular Weight |
414.51
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| Canonical SMILES |
CCn1ncc2c(NC3CCOCC3)c(cnc12)C(=O)NC1CCN(CC1)C(C)=O
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| InChI |
InChI=1S/C21H30N6O3/c1-3-27-20-17(13-23-27)19(24-16-6-10-30-11-7-16)18(12-22-20)21(29)25-15-4-8-26(9-5-15)14(2)28/h12-13,15-16H,3-11H2,1-2H3,(H,22,24)(H,25,29)
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| InChIKey |
PESOMZWNWQBAOB-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