General Information of the Compound
| Compound ID |
CP0867596
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| Compound Name |
2-(2-cyclohexylvinyl)-5-(2-fluoro-6-(trifluoromethyl)phenyl)-1H-benzo[d]imidazole
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| Structure |
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| Formula |
C22H20F4N2
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| Molecular Weight |
388.408
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| Canonical SMILES |
Fc1cccc(C(F)(F)F)c1-c1ccc2[nH]c(/C=C/C3CCCCC3)nc2c1
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| InChI |
InChI=1S/C22H20F4N2/c23-17-8-4-7-16(22(24,25)26)21(17)15-10-11-18-19(13-15)28-20(27-18)12-9-14-5-2-1-3-6-14/h4,7-14H,1-3,5-6H2,(H,27,28)/b12-9+
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| InChIKey |
XSTQIAIXSVSIPU-FMIVXFBMSA-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