General Information of the Compound
| Compound ID |
CP0558939
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| Compound Name |
N-benzyl-4-tert-butyl-N-(4-phenoxyphenyl)benzenesulfonamide
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| Structure |
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| Formula |
C29H29NO3S
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| Molecular Weight |
471.622
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| Canonical SMILES |
CC(C)(C)c1ccc(cc1)S(=O)(=O)N(Cc1ccccc1)c1ccc(Oc2ccccc2)cc1
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| InChI |
InChI=1S/C29H29NO3S/c1-29(2,3)24-14-20-28(21-15-24)34(31,32)30(22-23-10-6-4-7-11-23)25-16-18-27(19-17-25)33-26-12-8-5-9-13-26/h4-21H,22H2,1-3H3
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| InChIKey |
YOLGTLGNGVGTJU-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