General Information of the Compound
| Compound ID |
CP0906062
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| Compound Name |
rac-N-(1-(trans-2-Acrylamidocyclohexyl)-5-methyl-1H-benzo[d]-imidazol-2-yl)-3-(trifluoromethyl)benzamide
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| Structure |
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| Formula |
C25H25F3N4O2
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| Molecular Weight |
470.495
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| Canonical SMILES |
C=CC(=O)N[C@@H]1CCCC[C@H]1n1c(NC(=O)c2cccc(C(F)(F)F)c2)nc2cc(C)ccc21
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| InChI |
InChI=1S/C25H25F3N4O2/c1-3-22(33)29-18-9-4-5-10-20(18)32-21-12-11-15(2)13-19(21)30-24(32)31-23(34)16-7-6-8-17(14-16)25(26,27)28/h3,6-8,11-14,18,20H,1,4-5,9-10H2,2H3,(H,29,33)(H,30,31,34)/t18-,20-/m1/s1
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| InChIKey |
LGXYJFNAKDSBLF-UYAOXDASSA-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