General Information of the Compound
| Compound ID |
CP0446065
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| Compound Name |
6-(trifluoromethyl)-2-(4-(3-(trifluoromethyl)pyridin-2-yl)-piperazin-1-yl)-4-(3,4,5-trifluorophenyl)-1H-benzo[d]imidazole
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| Structure |
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| Formula |
C24H16F9N5
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| Molecular Weight |
545.409
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| Canonical SMILES |
Fc1cc(cc(F)c1F)-c1cc(cc2[nH]c(nc12)N1CCN(CC1)c1ncccc1C(F)(F)F)C(F)(F)F
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| InChI |
InChI=1S/C24H16F9N5/c25-16-8-12(9-17(26)19(16)27)14-10-13(23(28,29)30)11-18-20(14)36-22(35-18)38-6-4-37(5-7-38)21-15(24(31,32)33)2-1-3-34-21/h1-3,8-11H,4-7H2,(H,35,36)
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| InChIKey |
TVGAJVWISKWMLL-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