General Information of the Compound
| Compound ID |
CP0494070
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| Compound Name |
4-chloro-N-[[4-chloro-3-(trifluoromethyl)phenyl]methyl]-1,3-dimethylpyrazolo[3,4-b]pyridine-5-carboxamide
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| Structure |
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| Formula |
C17H13Cl2F3N4O
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| Molecular Weight |
417.218
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| Canonical SMILES |
Cc1nn(C)c2ncc(C(=O)NCc3ccc(Cl)c(c3)C(F)(F)F)c(Cl)c12
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| InChI |
InChI=1S/C17H13Cl2F3N4O/c1-8-13-14(19)10(7-23-15(13)26(2)25-8)16(27)24-6-9-3-4-12(18)11(5-9)17(20,21)22/h3-5,7H,6H2,1-2H3,(H,24,27)
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| InChIKey |
GOGQOBHFDBPZLG-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