General Information of the Compound
| Compound ID |
CP0554333
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| Compound Name |
4-fluoro-3-[2-methyl-5-[2-phenylmethoxy-5-(trifluoromethyl)phenyl]pyrrol-1-yl]benzoic acid
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| Structure |
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| Formula |
C26H19F4NO3
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| Molecular Weight |
469.434
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| Canonical SMILES |
Cc1ccc(-c2cc(ccc2OCc2ccccc2)C(F)(F)F)n1-c1cc(ccc1F)C(O)=O
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| InChI |
InChI=1S/C26H19F4NO3/c1-16-7-11-22(31(16)23-13-18(25(32)33)8-10-21(23)27)20-14-19(26(28,29)30)9-12-24(20)34-15-17-5-3-2-4-6-17/h2-14H,15H2,1H3,(H,32,33)
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| InChIKey |
OSFSJAGHPCSIGQ-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