General Information of the Compound
| Compound ID |
CP0339540
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| Compound Name |
2-(5-(4-(4-(trifluoromethyl)phenoxy)benzyloxy)-1H-indol-1-yl)acetic acid
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| Structure |
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| Formula |
C24H18F3NO4
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| Molecular Weight |
441.405
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| Canonical SMILES |
OC(=O)Cn1ccc2cc(OCc3ccc(Oc4ccc(cc4)C(F)(F)F)cc3)ccc12
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| InChI |
InChI=1S/C24H18F3NO4/c25-24(26,27)18-3-7-20(8-4-18)32-19-5-1-16(2-6-19)15-31-21-9-10-22-17(13-21)11-12-28(22)14-23(29)30/h1-13H,14-15H2,(H,29,30)
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| InChIKey |
ZDAMGGKWEUMTPY-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