General Information of the Compound
| Compound ID |
CP0423393
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| Compound Name |
2-(3-Benzenesulfonylamino-phenyl)-2-oxoethyl ethyl trithiocarbonate
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| Structure |
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| Formula |
C17H17NO3S4
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| Molecular Weight |
411.595
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| Canonical SMILES |
CCSC(=S)SCC(=O)c1cccc(NS(=O)(=O)c2ccccc2)c1
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| InChI |
InChI=1S/C17H17NO3S4/c1-2-23-17(22)24-12-16(19)13-7-6-8-14(11-13)18-25(20,21)15-9-4-3-5-10-15/h3-11,18H,2,12H2,1H3
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| InChIKey |
JNOFCFLOICBBCN-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