General Information of the Compound
| Compound ID |
CP0477652
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| Compound Name |
2-(2-benzhydryl-4-(2,5-dimethoxyphenyl)thiazol-5-yl)acetic acid
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| Structure |
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| Formula |
C26H23NO4S
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| Molecular Weight |
445.54
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| Canonical SMILES |
COc1ccc(OC)c(c1)-c1nc(sc1CC(O)=O)C(c1ccccc1)c1ccccc1
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| InChI |
InChI=1S/C26H23NO4S/c1-30-19-13-14-21(31-2)20(15-19)25-22(16-23(28)29)32-26(27-25)24(17-9-5-3-6-10-17)18-11-7-4-8-12-18/h3-15,24H,16H2,1-2H3,(H,28,29)
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| InChIKey |
WDKJUWYFSCMORY-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