General Information of the Compound
| Compound ID |
CP0494071
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| Compound Name |
4-chloro-N-[(3,5-dimethylphenyl)methyl]-1-ethylpyrazolo[3,4-b]pyridine-5-carboxamide
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| Structure |
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| Formula |
C18H19ClN4O
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| Molecular Weight |
342.83
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| Canonical SMILES |
CCn1ncc2c(Cl)c(cnc12)C(=O)NCc1cc(C)cc(C)c1
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| InChI |
InChI=1S/C18H19ClN4O/c1-4-23-17-14(10-22-23)16(19)15(9-20-17)18(24)21-8-13-6-11(2)5-12(3)7-13/h5-7,9-10H,4,8H2,1-3H3,(H,21,24)
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| InChIKey |
ZRRQJUPXCNJKDK-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