General Information of the Compound
| Compound ID |
CP0415762
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| Compound Name |
2-[4-[2-(3-tert-butylphenoxy)propanoylamino]-2-fluorophenoxy]acetic acid
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| Structure |
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| Formula |
C21H24FNO5
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| Molecular Weight |
389.423
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| Canonical SMILES |
CC(Oc1cccc(c1)C(C)(C)C)C(=O)Nc1ccc(OCC(O)=O)c(F)c1
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| InChI |
InChI=1S/C21H24FNO5/c1-13(28-16-7-5-6-14(10-16)21(2,3)4)20(26)23-15-8-9-18(17(22)11-15)27-12-19(24)25/h5-11,13H,12H2,1-4H3,(H,23,26)(H,24,25)
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| InChIKey |
OZWVCSQPNBCGOT-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