General Information of the Compound
| Compound ID |
CP0905126
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| Compound Name |
N-cyclopropyl-N-(1-(4-(methylsulfonyl)-2-(trifluoromethyl)benzoyl)azetidin-3-yl)-3-(trifluoromethyl)benzenesulfonamide
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| Structure |
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| Formula |
C22H20F6N2O5S2
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| Molecular Weight |
570.533
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| Canonical SMILES |
CS(=O)(=O)c1ccc(C(=O)N2CC(N(C3CC3)S(=O)(=O)c3cccc(C(F)(F)F)c3)C2)c(C(F)(F)F)c1
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| InChI |
InChI=1S/C22H20F6N2O5S2/c1-36(32,33)16-7-8-18(19(10-16)22(26,27)28)20(31)29-11-15(12-29)30(14-5-6-14)37(34,35)17-4-2-3-13(9-17)21(23,24)25/h2-4,7-10,14-15H,5-6,11-12H2,1H3
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| InChIKey |
HJZPUOLVSAJMGV-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