General Information of the Compound
| Compound ID |
CP0296303
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| Compound Name |
2-(5-((5-(4-(trifluoromethyl)phenyl)isoxazol-3-yl)methoxy)-1H-indol-1-yl)acetic acid
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| Structure |
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| Formula |
C21H15F3N2O4
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| Molecular Weight |
416.355
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| Canonical SMILES |
OC(=O)Cn1ccc2cc(OCc3cc(on3)-c3ccc(cc3)C(F)(F)F)ccc12
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| InChI |
InChI=1S/C21H15F3N2O4/c22-21(23,24)15-3-1-13(2-4-15)19-10-16(25-30-19)12-29-17-5-6-18-14(9-17)7-8-26(18)11-20(27)28/h1-10H,11-12H2,(H,27,28)
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| InChIKey |
GPOKBAQNQTXHEM-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