General Information of the Compound
| Compound ID |
CP0559477
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| Compound Name |
2-(5,6-dimethoxypyridin-3-yl)-5-[2-(1,2,4-triazol-1-yl)-5-(trifluoromethoxy)phenyl]-1,3,4-oxadiazole
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| Structure |
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| Formula |
C18H13F3N6O4
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| Molecular Weight |
434.334
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| Canonical SMILES |
COc1cc(cnc1OC)-c1nnc(o1)-c1cc(OC(F)(F)F)ccc1-n1cncn1
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| InChI |
InChI=1S/C18H13F3N6O4/c1-28-14-5-10(7-23-17(14)29-2)15-25-26-16(30-15)12-6-11(31-18(19,20)21)3-4-13(12)27-9-22-8-24-27/h3-9H,1-2H3
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| InChIKey |
AWOCZGDZTBWFLA-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