General Information of the Compound
| Compound ID |
CP0410587
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| Compound Name |
2-[bis(4-methylphenyl)methylsulfinylmethyl]thiophene
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| Structure |
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| Formula |
C20H20OS2
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| Molecular Weight |
340.513
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| Canonical SMILES |
Cc1ccc(cc1)C([S+]([O-])Cc1cccs1)c1ccc(C)cc1
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| InChI |
InChI=1S/C20H20OS2/c1-15-5-9-17(10-6-15)20(18-11-7-16(2)8-12-18)23(21)14-19-4-3-13-22-19/h3-13,20H,14H2,1-2H3
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| InChIKey |
QUMHMNSOISGBJC-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