General Information of the Compound
| Compound ID |
CP0442641
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| Compound Name |
4-Benzyl-1H-imidazole derivative, 19
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| Synonyms |
4-(3-Phenylethynyl-benzyl)-1H-imidazole
4-Benzyl-1H-imidazole derivative, 19
BDBM22538
CHEMBL449840
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| Structure |
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| Formula |
C18H14N2
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| Molecular Weight |
258.324
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| Canonical SMILES |
C(c1cnc[nH]1)c1cccc(c1)C#Cc1ccccc1
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| InChI |
InChI=1S/C18H14N2/c1-2-5-15(6-3-1)9-10-16-7-4-8-17(11-16)12-18-13-19-14-20-18/h1-8,11,13-14H,12H2,(H,19,20)
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| InChIKey |
VIPAIZRIFZFESY-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
Clinical Information about the Compound