General Information of the Compound
| Compound ID |
CP0534300
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| Compound Name |
(2E)-2-[[2-[(4-fluorophenyl)methoxy]-5-(naphthalen-2-ylmethoxy)phenyl]methylidene]pentanoic acid
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| Structure |
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| Formula |
C30H27FO4
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| Molecular Weight |
470.54
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| Canonical SMILES |
CCC\C(=C/c1cc(OCc2ccc3ccccc3c2)ccc1OCc1ccc(F)cc1)C(O)=O
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| InChI |
InChI=1S/C30H27FO4/c1-2-5-25(30(32)33)17-26-18-28(14-15-29(26)35-19-21-9-12-27(31)13-10-21)34-20-22-8-11-23-6-3-4-7-24(23)16-22/h3-4,6-18H,2,5,19-20H2,1H3,(H,32,33)/b25-17+
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| InChIKey |
ATTLVLBGSRXTLU-KOEQRZSOSA-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