General Information of the Compound
| Compound ID |
CP0264731
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| Compound Name |
N-[3-(4-fluorophenyl)-3-(4-methylsulfonylphenyl)propyl]-4-methylsulfonylbenzamide
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| Structure |
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| Formula |
C24H24FNO5S2
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| Molecular Weight |
489.59
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| Canonical SMILES |
CS(=O)(=O)c1ccc(cc1)C(CCNC(=O)c1ccc(cc1)S(C)(=O)=O)c1ccc(F)cc1
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| InChI |
InChI=1S/C24H24FNO5S2/c1-32(28,29)21-11-5-18(6-12-21)23(17-3-9-20(25)10-4-17)15-16-26-24(27)19-7-13-22(14-8-19)33(2,30)31/h3-14,23H,15-16H2,1-2H3,(H,26,27)
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| InChIKey |
DNQNCWYXHIIHGR-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