General Information of the Compound
| Compound ID |
CP0425295
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| Compound Name |
3-[3-chloro-4-[[3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl]methoxy]phenyl]propanoic acid
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| Structure |
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| Formula |
C19H14ClF3N2O4
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| Molecular Weight |
426.778
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| Canonical SMILES |
OC(=O)CCc1ccc(OCc2nc(no2)-c2cccc(c2)C(F)(F)F)c(Cl)c1
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| InChI |
InChI=1S/C19H14ClF3N2O4/c20-14-8-11(5-7-17(26)27)4-6-15(14)28-10-16-24-18(25-29-16)12-2-1-3-13(9-12)19(21,22)23/h1-4,6,8-9H,5,7,10H2,(H,26,27)
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| InChIKey |
VLULWUWLJHVBQE-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