General Information of the Compound
| Compound ID |
CP0503931
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| Compound Name |
6-(trifluoromethyl)-4-(4-(trifluoromethyl)cyclohexyl)-2-(4-(3-(trifluoromethyl)pyridin-2-yl)piperazin-1-yl)-1H-benzo[d]-imidazole
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| Structure |
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| Formula |
C25H24F9N5
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| Molecular Weight |
565.484
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| Canonical SMILES |
FC(F)(F)C1CCC(CC1)c1cc(cc2[nH]c(nc12)N1CCN(CC1)c1ncccc1C(F)(F)F)C(F)(F)F
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| InChI |
InChI=1S/C25H24F9N5/c26-23(27,28)15-5-3-14(4-6-15)17-12-16(24(29,30)31)13-19-20(17)37-22(36-19)39-10-8-38(9-11-39)21-18(25(32,33)34)2-1-7-35-21/h1-2,7,12-15H,3-6,8-11H2,(H,36,37)
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| InChIKey |
NIIAQTBAGJKCOV-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