General Information of the Compound
| Compound ID |
CP0536033
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| Compound Name |
4-[5-(4-Fluoro-phenyl)-2-(4-methanesulfinyl-phenyl)-3H-imidazol-4-yl]-3-methyl-pyridine
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| Structure |
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| Formula |
C22H18FN3OS
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| Molecular Weight |
391.471
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| Canonical SMILES |
Cc1cnccc1-c1nc([nH]c1-c1ccc(F)cc1)-c1ccc(cc1)S(C)=O
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| InChI |
InChI=1S/C22H18FN3OS/c1-14-13-24-12-11-19(14)21-20(15-3-7-17(23)8-4-15)25-22(26-21)16-5-9-18(10-6-16)28(2)27/h3-13H,1-2H3,(H,25,26)
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| InChIKey |
VAKYZYMJYLMPIA-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