General Information of the Compound
| Compound ID |
CP0501264
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| Compound Name |
1-(4-bromophenyl)-3-(phenylsulfonyl)propan-1-one
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| Structure |
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| Formula |
C15H13BrO3S
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| Molecular Weight |
353.237
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| Canonical SMILES |
Brc1ccc(cc1)C(=O)CCS(=O)(=O)c1ccccc1
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| InChI |
InChI=1S/C15H13BrO3S/c16-13-8-6-12(7-9-13)15(17)10-11-20(18,19)14-4-2-1-3-5-14/h1-9H,10-11H2
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| InChIKey |
JTTFAPOPYCJPGZ-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