General Information of the Compound
Compound ID |
CP0564971
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Compound Name |
5-(2-chloro-6-methoxypyridin-4-yl)-3-(1,3-dimethyl-4-propan-2-ylpyrazolo[3,4-b]pyridin-6-yl)-1,2,4-oxadiazole
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Structure |
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Formula |
C19H19ClN6O2
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Molecular Weight |
398.854
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Canonical SMILES |
COc1cc(cc(Cl)n1)-c1nc(no1)-c1cc(C(C)C)c2c(C)nn(C)c2n1
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InChI |
InChI=1S/C19H19ClN6O2/c1-9(2)12-8-13(21-18-16(12)10(3)24-26(18)4)17-23-19(28-25-17)11-6-14(20)22-15(7-11)27-5/h6-9H,1-5H3
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InChIKey |
PYBOEGZYHNYMBQ-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