General Information of the Compound
| Compound ID |
CP0481040
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| Compound Name |
4-phenyl-N-[[3-(trifluoromethyl)phenyl]methyl]-1H-benzimidazole-2-carboxamide
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| Structure |
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| Formula |
C22H16F3N3O
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| Molecular Weight |
395.384
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| Canonical SMILES |
FC(F)(F)c1cccc(CNC(=O)c2nc3c(cccc3[nH]2)-c2ccccc2)c1
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| InChI |
InChI=1S/C22H16F3N3O/c23-22(24,25)16-9-4-6-14(12-16)13-26-21(29)20-27-18-11-5-10-17(19(18)28-20)15-7-2-1-3-8-15/h1-12H,13H2,(H,26,29)(H,27,28)
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| InChIKey |
OSGCZBSBEOQWOA-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: PT01298, Cannabinoid receptor 1
Protein ID: PT00834, Cannabinoid receptor 2