General Information of the Compound
| Compound ID |
CP0736650
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| Compound Name |
Sodium salt 6-(4'-fluoro-3,5-diisopropyl-biphenyl-2-yloxy)-3,5-dihydroxy-hexanoate
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| Structure |
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| Formula |
C24H30FNaO5
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| Molecular Weight |
440.487
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| Canonical SMILES |
CC(C)c1cc(-c2ccc(F)cc2)c(OCC(O)C[C@@H](O)CC(=O)[O-])c(C(C)C)c1.[Na+]
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| InChI |
InChI=1S/C24H31FO5.Na/c1-14(2)17-9-21(15(3)4)24(22(10-17)16-5-7-18(25)8-6-16)30-13-20(27)11-19(26)12-23(28)29;/h5-10,14-15,19-20,26-27H,11-13H2,1-4H3,(H,28,29);/q;+1/p-1/t19-,20?;/m1./s1
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| InChIKey |
OPGUJBRXGFLUTL-FVXGQCTOSA-M
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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