General Information of the Compound
| Compound ID |
CP0425946
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| Compound Name |
1-((1H-Imidazol-4-yl)methyl)-4-(4-trifluoromethylphenyl)-piperazine
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| Structure |
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| Formula |
C15H17F3N4
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| Molecular Weight |
310.323
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| Canonical SMILES |
FC(F)(F)c1ccc(cc1)N1CCN(Cc2cnc[nH]2)CC1
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| InChI |
InChI=1S/C15H17F3N4/c16-15(17,18)12-1-3-14(4-2-12)22-7-5-21(6-8-22)10-13-9-19-11-20-13/h1-4,9,11H,5-8,10H2,(H,19,20)
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| InChIKey |
LMIYNBLFZFTTLT-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