General Information of the Compound
| Compound ID |
CP0425297
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| Compound Name |
3-[4-[1-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]ethoxy]phenyl]propanoic acid
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| Structure |
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| Formula |
C19H17ClN2O4
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| Molecular Weight |
372.808
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| Canonical SMILES |
CC(Oc1ccc(CCC(O)=O)cc1)c1nc(no1)-c1ccc(Cl)cc1
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| InChI |
InChI=1S/C19H17ClN2O4/c1-12(25-16-9-2-13(3-10-16)4-11-17(23)24)19-21-18(22-26-19)14-5-7-15(20)8-6-14/h2-3,5-10,12H,4,11H2,1H3,(H,23,24)
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| InChIKey |
KXWNMHUBWDFCOE-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