General Information of the Compound
| Compound ID |
CP0495034
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| Compound Name |
3-Fluoro-5-(2-oxo-3-phenyl-2,3-dihydro-1H-benzoimidazol-5-yl)-benzonitrile
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| Structure |
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| Formula |
C20H12FN3O
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| Molecular Weight |
329.334
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| Canonical SMILES |
Fc1cc(cc(c1)-c1ccc2[nH]c(=O)n(-c3ccccc3)c2c1)C#N
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| InChI |
InChI=1S/C20H12FN3O/c21-16-9-13(12-22)8-15(10-16)14-6-7-18-19(11-14)24(20(25)23-18)17-4-2-1-3-5-17/h1-11H,(H,23,25)
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| InChIKey |
UVJHHVUGFWINDC-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