General Information of the Compound
| Compound ID |
CP0541348
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| Compound Name |
6-tert-butyl-2-(4-(3-(trifluoromethyl)pyridin-2-yl)piperazin-1-yl)-1H-benzo[d]imidazole
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| Structure |
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| Formula |
C21H24F3N5
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| Molecular Weight |
403.452
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| Canonical SMILES |
CC(C)(C)c1ccc2nc([nH]c2c1)N1CCN(CC1)c1ncccc1C(F)(F)F
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| InChI |
InChI=1S/C21H24F3N5/c1-20(2,3)14-6-7-16-17(13-14)27-19(26-16)29-11-9-28(10-12-29)18-15(21(22,23)24)5-4-8-25-18/h4-8,13H,9-12H2,1-3H3,(H,26,27)
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| InChIKey |
UGQHQQHLNZVKEI-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