General Information of the Compound
| Compound ID |
CP0558843
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| Compound Name |
N-phenyl-2-[4-[2-[4-(trifluoromethoxy)phenoxy]ethyl]piperazin-1-yl]acetamide
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| Structure |
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| Formula |
C21H24F3N3O3
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| Molecular Weight |
423.435
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| Canonical SMILES |
FC(F)(F)Oc1ccc(OCCN2CCN(CC(=O)Nc3ccccc3)CC2)cc1
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| InChI |
InChI=1S/C21H24F3N3O3/c22-21(23,24)30-19-8-6-18(7-9-19)29-15-14-26-10-12-27(13-11-26)16-20(28)25-17-4-2-1-3-5-17/h1-9H,10-16H2,(H,25,28)
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| InChIKey |
VXXGHNVSAXNMRC-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