General Information of the Compound
| Compound ID |
CP0090691
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| Compound Name |
(E)-2-(5-Fluoro-1-((4-fluoronaphthalen-1-yl)methylene)-1H-inden-3-yl)ethanoic acid
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| Structure |
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| Formula |
C22H14F2O2
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| Molecular Weight |
348.348
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| Canonical SMILES |
OC(=O)CC1=C\C(=C/c2ccc(F)c3ccccc23)c2ccc(F)cc12
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| InChI |
InChI=1S/C22H14F2O2/c23-16-6-7-18-14(10-15(11-22(25)26)20(18)12-16)9-13-5-8-21(24)19-4-2-1-3-17(13)19/h1-10,12H,11H2,(H,25,26)/b14-9+
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| InChIKey |
SPRHRBGCDSYOLX-NTEUORMPSA-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