General Information of the Compound
| Compound ID |
CP0541683
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| Compound Name |
1-benzyl-2-[[4-[6-chloro-3-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]methyl]benzimidazole
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| Structure |
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| Formula |
C25H23ClF3N5
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| Molecular Weight |
485.941
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| Canonical SMILES |
FC(F)(F)c1ccc(Cl)nc1N1CCN(Cc2nc3ccccc3n2Cc2ccccc2)CC1
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| InChI |
InChI=1S/C25H23ClF3N5/c26-22-11-10-19(25(27,28)29)24(31-22)33-14-12-32(13-15-33)17-23-30-20-8-4-5-9-21(20)34(23)16-18-6-2-1-3-7-18/h1-11H,12-17H2
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| InChIKey |
CMONBQNOTZZEIC-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