General Information of the Compound
| Compound ID |
CP0550388
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| Compound Name |
3-[3,5-difluoro-4-[[3-phenyl-5-(trifluoromethyl)-1,2-oxazol-4-yl]methoxy]phenyl]propanoic acid
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| Structure |
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| Formula |
C20H14F5NO4
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| Molecular Weight |
427.325
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| Canonical SMILES |
OC(=O)CCc1cc(F)c(OCc2c(noc2C(F)(F)F)-c2ccccc2)c(F)c1
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| InChI |
InChI=1S/C20H14F5NO4/c21-14-8-11(6-7-16(27)28)9-15(22)18(14)29-10-13-17(12-4-2-1-3-5-12)26-30-19(13)20(23,24)25/h1-5,8-9H,6-7,10H2,(H,27,28)
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| InChIKey |
VLMVZCMWQUZFFA-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