General Information of the Compound
| Compound ID |
CP0511046
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| Compound Name |
3-[3-chloro-4-[[3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methoxy]phenyl]propanoic acid
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| Structure |
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| Formula |
C19H17ClN2O5
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| Molecular Weight |
388.807
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| Canonical SMILES |
COc1cccc(c1)-c1noc(COc2ccc(CCC(O)=O)cc2Cl)n1
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| InChI |
InChI=1S/C19H17ClN2O5/c1-25-14-4-2-3-13(10-14)19-21-17(27-22-19)11-26-16-7-5-12(9-15(16)20)6-8-18(23)24/h2-5,7,9-10H,6,8,11H2,1H3,(H,23,24)
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| InChIKey |
ZNUMOPISFAQBBW-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