General Information of the Compound
| Compound ID |
CP0535011
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| Compound Name |
N-[2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-5-methylpyridin-4-yl]-6-(1-methylpyrazol-4-yl)pyridine-2-carboxamide
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| Structure |
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| Formula |
C22H26N6O2
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| Molecular Weight |
406.49
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| Canonical SMILES |
C[C@H]1CN(C[C@@H](C)O1)c1cc(NC(=O)c2cccc(n2)-c2cnn(C)c2)c(C)cn1
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| InChI |
InChI=1S/C22H26N6O2/c1-14-9-23-21(28-11-15(2)30-16(3)12-28)8-20(14)26-22(29)19-7-5-6-18(25-19)17-10-24-27(4)13-17/h5-10,13,15-16H,11-12H2,1-4H3,(H,23,26,29)/t15-,16+
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| InChIKey |
MDHMXWJWNZSMEC-IYBDPMFKSA-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