General Information of the Compound
| Compound ID |
CP0579006
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| Compound Name |
2-[2-fluoro-4-[(3-phenylphenyl)methylamino]phenoxy]acetic acid
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| Structure |
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| Formula |
C21H18FNO3
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| Molecular Weight |
351.377
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| Canonical SMILES |
OC(=O)COc1ccc(NCc2cccc(c2)-c2ccccc2)cc1F
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| InChI |
InChI=1S/C21H18FNO3/c22-19-12-18(9-10-20(19)26-14-21(24)25)23-13-15-5-4-8-17(11-15)16-6-2-1-3-7-16/h1-12,23H,13-14H2,(H,24,25)
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| InChIKey |
WMHHBFMCSCOKOQ-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