General Information of the Compound
| Compound ID |
CP0428619
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| Compound Name |
5-(acetamidomethyl)-2-(difluoromethyl)-N-[5-methyl-4-[4-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]pyridine-3-carboxamide
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| Structure |
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| Formula |
C21H18F5N5O2
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| Molecular Weight |
467.398
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| Canonical SMILES |
CC(=O)NCc1cnc(C(F)F)c(c1)C(=O)Nc1nc(C)c([nH]1)-c1ccc(cc1)C(F)(F)F
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| InChI |
InChI=1S/C21H18F5N5O2/c1-10-16(13-3-5-14(6-4-13)21(24,25)26)30-20(29-10)31-19(33)15-7-12(8-27-11(2)32)9-28-17(15)18(22)23/h3-7,9,18H,8H2,1-2H3,(H,27,32)(H2,29,30,31,33)
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| InChIKey |
CGMKDDSJYWMDOQ-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