General Information of the Compound
| Compound ID |
CP0417877
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| Compound Name |
2-(4-(4-fluorophenyl)-2-((4-hydroxyphenyl)(phenyl)methyl)thiazol-5-yl)acetic acid
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| Structure |
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| Formula |
C24H18FNO3S
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| Molecular Weight |
419.477
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| Canonical SMILES |
OC(=O)Cc1sc(nc1-c1ccc(F)cc1)C(c1ccccc1)c1ccc(O)cc1
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| InChI |
InChI=1S/C24H18FNO3S/c25-18-10-6-17(7-11-18)23-20(14-21(28)29)30-24(26-23)22(15-4-2-1-3-5-15)16-8-12-19(27)13-9-16/h1-13,22,27H,14H2,(H,28,29)
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| InChIKey |
IIMVGFRDUDAYTR-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