General Information of the Compound
| Compound ID |
CP0200400
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| Compound Name |
2-(4-(3-(4-(4-fluorophenoxy)-2-propylphenoxy)propoxy)phenoxy)-2-methylpropanoic acid
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| Structure |
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| Formula |
C28H31FO6
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| Molecular Weight |
482.548
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| Canonical SMILES |
CCCc1cc(Oc2ccc(F)cc2)ccc1OCCCOc1ccc(OC(C)(C)C(O)=O)cc1
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| InChI |
InChI=1S/C28H31FO6/c1-4-6-20-19-25(34-23-9-7-21(29)8-10-23)15-16-26(20)33-18-5-17-32-22-11-13-24(14-12-22)35-28(2,3)27(30)31/h7-16,19H,4-6,17-18H2,1-3H3,(H,30,31)
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| InChIKey |
KNJGJMPLAFPORU-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