General Information of the Compound
| Compound ID |
CP0701641
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| Compound Name |
rac-4-(2-Bicyclo[2.2.2]octanyl)-3-methyl-2,7-dihydropyrazolo-[3,4-b]pyridin-6-one
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| Structure |
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| Formula |
C15H19N3O
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| Molecular Weight |
257.337
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| Canonical SMILES |
Cc1[nH]nc2[nH]c(=O)cc(C3CC4CCC3CC4)c12
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| InChI |
InChI=1S/C15H19N3O/c1-8-14-12(7-13(19)16-15(14)18-17-8)11-6-9-2-4-10(11)5-3-9/h7,9-11H,2-6H2,1H3,(H2,16,17,18,19)
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| InChIKey |
OSPGWPLTUVOFKX-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