General Information of the Compound
| Compound ID |
CP0850462
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| Compound Name |
N-(1-(4-Acrylamidophenyl)-5-methyl-1H-benzo[d]imidazol-2-yl)-3-(trifluoromethyl)benzamide
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| Structure |
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| Formula |
C25H19F3N4O2
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| Molecular Weight |
464.447
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| Canonical SMILES |
C=CC(=O)Nc1ccc(-n2c(NC(=O)c3cccc(C(F)(F)F)c3)nc3cc(C)ccc32)cc1
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| InChI |
InChI=1S/C25H19F3N4O2/c1-3-22(33)29-18-8-10-19(11-9-18)32-21-12-7-15(2)13-20(21)30-24(32)31-23(34)16-5-4-6-17(14-16)25(26,27)28/h3-14H,1H2,2H3,(H,29,33)(H,30,31,34)
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| InChIKey |
WUXQLCNEKRVHGT-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