General Information of the Compound
| Compound ID |
CP0512108
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| Compound Name |
4-(4-chloropyridin-3-yl)-1-(2,2,2-trifluoroethyl)benzimidazole
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| Structure |
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| Formula |
C14H9ClF3N3
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| Molecular Weight |
311.694
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| Canonical SMILES |
FC(F)(F)Cn1cnc2c(cccc12)-c1cnccc1Cl
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| InChI |
InChI=1S/C14H9ClF3N3/c15-11-4-5-19-6-10(11)9-2-1-3-12-13(9)20-8-21(12)7-14(16,17)18/h1-6,8H,7H2
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| InChIKey |
KKTWOTWJWKXLRY-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