General Information of the Compound
| Compound ID |
CP0443543
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| Compound Name |
N-[[1-(hydroxymethyl)cyclohexyl]methyl]-4-phenyl-1-(2,2,2-trifluoroethyl)benzimidazole-2-carboxamide
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| Structure |
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| Formula |
C24H26F3N3O2
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| Molecular Weight |
445.485
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| Canonical SMILES |
OCC1(CNC(=O)c2nc3c(cccc3n2CC(F)(F)F)-c2ccccc2)CCCCC1
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| InChI |
InChI=1S/C24H26F3N3O2/c25-24(26,27)15-30-19-11-7-10-18(17-8-3-1-4-9-17)20(19)29-21(30)22(32)28-14-23(16-31)12-5-2-6-13-23/h1,3-4,7-11,31H,2,5-6,12-16H2,(H,28,32)
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| InChIKey |
WSLLFUZFPYVTFT-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