General Information of the Compound
| Compound ID |
CP0385020
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| Compound Name |
3-[4-[[3-cyclopentyloxy-5-(3,5-dimethyl-1,2-oxazol-4-yl)phenyl]methoxy]-2-fluorophenyl]propanoic acid
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| Structure |
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| Formula |
C26H28FNO5
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| Molecular Weight |
453.51
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| Canonical SMILES |
Cc1noc(C)c1-c1cc(COc2ccc(CCC(O)=O)c(F)c2)cc(OC2CCCC2)c1
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| InChI |
InChI=1S/C26H28FNO5/c1-16-26(17(2)33-28-16)20-11-18(12-23(13-20)32-21-5-3-4-6-21)15-31-22-9-7-19(24(27)14-22)8-10-25(29)30/h7,9,11-14,21H,3-6,8,10,15H2,1-2H3,(H,29,30)
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| InChIKey |
ROSISGLBNXNKRR-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