General Information of the Compound
| Compound ID |
CP0539172
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| Compound Name |
4-[2-[[3-fluoro-5-(trifluoromethyl)phenyl]methyl]-4-methyl-1,3-thiazol-5-yl]-2-methylbenzamide
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| Structure |
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| Formula |
C20H16F4N2OS
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| Molecular Weight |
408.42
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| Canonical SMILES |
Cc1nc(Cc2cc(F)cc(c2)C(F)(F)F)sc1-c1ccc(C(N)=O)c(C)c1
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| InChI |
InChI=1S/C20H16F4N2OS/c1-10-5-13(3-4-16(10)19(25)27)18-11(2)26-17(28-18)8-12-6-14(20(22,23)24)9-15(21)7-12/h3-7,9H,8H2,1-2H3,(H2,25,27)
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| InChIKey |
VPAANHFSDVELKX-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