General Information of the Compound
| Compound ID |
CP0467974
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| Compound Name |
2-Chloro-1-(4-fluoro-phenyl)-5-(4-methanesulfonyl-phenyl)-4-methyl-1H-imidazole
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| Structure |
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| Formula |
C17H14ClFN2O2S
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| Molecular Weight |
364.829
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| Canonical SMILES |
Cc1nc(Cl)n(c1-c1ccc(cc1)S(C)(=O)=O)-c1ccc(F)cc1
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| InChI |
InChI=1S/C17H14ClFN2O2S/c1-11-16(12-3-9-15(10-4-12)24(2,22)23)21(17(18)20-11)14-7-5-13(19)6-8-14/h3-10H,1-2H3
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| InChIKey |
NAUBUHLGUBYXRS-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
Protein ID: PT00940, Prostaglandin G/H synthase 1
Protein ID: PT00901, Prostaglandin G/H synthase 2