General Information of the Compound
| Compound ID |
CP0405716
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| Compound Name |
2-[2-cyano-5-[(2-fluoropyridin-4-yl)methoxy]phenoxy]-2-(2-methylphenyl)acetic acid
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| Structure |
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| Formula |
C22H17FN2O4
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| Molecular Weight |
392.386
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| Canonical SMILES |
Cc1ccccc1C(Oc1cc(OCc2ccnc(F)c2)ccc1C#N)C(O)=O
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| InChI |
InChI=1S/C22H17FN2O4/c1-14-4-2-3-5-18(14)21(22(26)27)29-19-11-17(7-6-16(19)12-24)28-13-15-8-9-25-20(23)10-15/h2-11,21H,13H2,1H3,(H,26,27)
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| InChIKey |
GSJIZNKEIYNECC-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