General Information of the Compound
| Compound ID |
CP0447328
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| Compound Name |
2-(benzhydrylsulfinylmethyl)-3-chlorothiophene
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| Structure |
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| Formula |
C18H15ClOS2
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| Molecular Weight |
346.904
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| Canonical SMILES |
[O-][S+](Cc1sccc1Cl)C(c1ccccc1)c1ccccc1
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| InChI |
InChI=1S/C18H15ClOS2/c19-16-11-12-21-17(16)13-22(20)18(14-7-3-1-4-8-14)15-9-5-2-6-10-15/h1-12,18H,13H2
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| InChIKey |
BSRSVYCJTVSYKB-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