General Information of the Compound
| Compound ID |
CP0544779
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| Compound Name |
N-[[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]methyl]-N-methyl-2-[2-[methyl-[2-(trifluoromethyl)phenyl]sulfonylamino]ethoxy]acetamide
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| Structure |
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| Formula |
C23H27F3N4O4S
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| Molecular Weight |
512.554
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| Canonical SMILES |
CN(Cc1ccc(cc1)C1=NCCN1)C(=O)COCCN(C)S(=O)(=O)c1ccccc1C(F)(F)F
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| InChI |
InChI=1S/C23H27F3N4O4S/c1-29(15-17-7-9-18(10-8-17)22-27-11-12-28-22)21(31)16-34-14-13-30(2)35(32,33)20-6-4-3-5-19(20)23(24,25)26/h3-10H,11-16H2,1-2H3,(H,27,28)
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| InChIKey |
PVJPHTHOJCLEHM-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