General Information of the Compound
| Compound ID |
CP0493541
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| Compound Name |
2-[4-[(4-chloro-3-phenylphenyl)methylamino]-2-fluorophenoxy]acetic acid
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| Structure |
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| Formula |
C21H17ClFNO3
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| Molecular Weight |
385.822
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| Canonical SMILES |
OC(=O)COc1ccc(NCc2ccc(Cl)c(c2)-c2ccccc2)cc1F
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| InChI |
InChI=1S/C21H17ClFNO3/c22-18-8-6-14(10-17(18)15-4-2-1-3-5-15)12-24-16-7-9-20(19(23)11-16)27-13-21(25)26/h1-11,24H,12-13H2,(H,25,26)
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| InChIKey |
PZSMXTGVRXJKGG-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