General Information of the Compound
| Compound ID |
CP0404319
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| Compound Name |
2-[4-[[2-(3-methoxyphenyl)-4-methyl-1,3-oxazol-5-yl]methoxy]phenyl]acetic acid
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| Structure |
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| Formula |
C20H19NO5
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| Molecular Weight |
353.374
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| Canonical SMILES |
COc1cccc(c1)-c1nc(C)c(COc2ccc(CC(O)=O)cc2)o1
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| InChI |
InChI=1S/C20H19NO5/c1-13-18(12-25-16-8-6-14(7-9-16)10-19(22)23)26-20(21-13)15-4-3-5-17(11-15)24-2/h3-9,11H,10,12H2,1-2H3,(H,22,23)
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| InChIKey |
BTEJSQVRGFHBMU-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
Protein ID: PT00909, Peroxisome proliferator-activated receptor delta
Protein ID: PT02378, Vitamin D3 receptor