General Information of the Compound
| Compound ID |
CP0458519
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| Compound Name |
1-(4-methyl-5-(4-(trifluoromethyl)phenyl)-1H-imidazol-2-yl)-4-(3-(trifluoromethyl)pyridin-2-yl)piperazine
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| Structure |
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| Formula |
C21H19F6N5
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| Molecular Weight |
455.406
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| Canonical SMILES |
Cc1[nH]c(nc1-c1ccc(cc1)C(F)(F)F)N1CCN(CC1)c1ncccc1C(F)(F)F
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| InChI |
InChI=1S/C21H19F6N5/c1-13-17(14-4-6-15(7-5-14)20(22,23)24)30-19(29-13)32-11-9-31(10-12-32)18-16(21(25,26)27)3-2-8-28-18/h2-8H,9-12H2,1H3,(H,29,30)
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| InChIKey |
IUPFDVMGTMCZRO-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