General Information of the Compound
| Compound ID |
CP0046808
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| Compound Name |
2-[2-(2,6-dimethylpyridin-3-yl)oxyethylamino]-4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyridine-3-carbonitrile
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| Structure |
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| Formula |
C20H23N7O
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| Molecular Weight |
377.452
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| Canonical SMILES |
Cc1cc(Nc2cc(C)c(C#N)c(NCCOc3ccc(C)nc3C)n2)n[nH]1
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| InChI |
InChI=1S/C20H23N7O/c1-12-9-18(24-19-10-14(3)26-27-19)25-20(16(12)11-21)22-7-8-28-17-6-5-13(2)23-15(17)4/h5-6,9-10H,7-8H2,1-4H3,(H3,22,24,25,26,27)
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| InChIKey |
KMUQNRCFLITLEM-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