General Information of the Compound
| Compound ID |
CP0558474
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| Compound Name |
3-[4-[[3-(4-chlorophenyl)-5-phenyl-1,2-oxazol-4-yl]methoxy]-2,3-dimethylphenyl]propanoic acid
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| Structure |
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| Formula |
C27H24ClNO4
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| Molecular Weight |
461.945
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| Canonical SMILES |
Cc1c(C)c(OCc2c(noc2-c2ccccc2)-c2ccc(Cl)cc2)ccc1CCC(O)=O
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| InChI |
InChI=1S/C27H24ClNO4/c1-17-18(2)24(14-10-19(17)11-15-25(30)31)32-16-23-26(20-8-12-22(28)13-9-20)29-33-27(23)21-6-4-3-5-7-21/h3-10,12-14H,11,15-16H2,1-2H3,(H,30,31)
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| InChIKey |
NUZGNYTXCQXONV-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