General Information of the Compound
| Compound ID |
CP0573750
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| Compound Name |
5-[2-(2-chloro-6-fluorophenyl)-1H-imidazol-5-yl]-2-[2-(3-chlorophenyl)ethynyl]pyridine
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| Structure |
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| Formula |
C22H12Cl2FN3
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| Molecular Weight |
408.263
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| Canonical SMILES |
Fc1cccc(Cl)c1-c1nc(c[nH]1)-c1ccc(nc1)C#Cc1cccc(Cl)c1
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| InChI |
InChI=1S/C22H12Cl2FN3/c23-16-4-1-3-14(11-16)7-9-17-10-8-15(12-26-17)20-13-27-22(28-20)21-18(24)5-2-6-19(21)25/h1-6,8,10-13H,(H,27,28)
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| InChIKey |
UTDKSHVYJKSKBJ-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