General Information of the Compound
| Compound ID |
CP0390767
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| Compound Name |
2-[3-[2-[(4-chlorophenyl)methylcarbamoyl]-4-(propanoylamino)phenoxy]-4-methoxyphenyl]acetic acid
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| Structure |
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| Formula |
C26H25ClN2O6
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| Molecular Weight |
496.947
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| Canonical SMILES |
CCC(=O)Nc1ccc(Oc2cc(CC(O)=O)ccc2OC)c(c1)C(=O)NCc1ccc(Cl)cc1
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| InChI |
InChI=1S/C26H25ClN2O6/c1-3-24(30)29-19-9-11-21(35-23-12-17(13-25(31)32)6-10-22(23)34-2)20(14-19)26(33)28-15-16-4-7-18(27)8-5-16/h4-12,14H,3,13,15H2,1-2H3,(H,28,33)(H,29,30)(H,31,32)
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| InChIKey |
SRHRRGWXXWRBJT-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