General Information of the Compound
| Compound ID |
CP0561696
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| Compound Name |
3-methoxy-1-methyl-N-[6-[4-[(3R)-oxolan-3-yl]-1,2,4-triazol-3-yl]pyridin-2-yl]pyrazole-4-carboxamide
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| Structure |
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| Formula |
C17H19N7O3
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| Molecular Weight |
369.385
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| Canonical SMILES |
COc1nn(C)cc1C(=O)Nc1cccc(n1)-c1nncn1[C@@H]1CCOC1
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| InChI |
InChI=1S/C17H19N7O3/c1-23-8-12(17(22-23)26-2)16(25)20-14-5-3-4-13(19-14)15-21-18-10-24(15)11-6-7-27-9-11/h3-5,8,10-11H,6-7,9H2,1-2H3,(H,19,20,25)/t11-/m1/s1
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| InChIKey |
SCYJLANTBOIPFX-LLVKDONJSA-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