General Information of the Compound
| Compound ID |
CP0213593
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| Compound Name |
2-(2-indolin-1-yl-2-keto-ethyl)-1,1-diketo-1,2-benzothiazol-3-one
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| Structure |
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| Formula |
C17H14N2O4S
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| Molecular Weight |
342.376
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| Canonical SMILES |
O=C(CN1C(=O)c2ccccc2S1(=O)=O)N1CCc2ccccc12
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| InChI |
InChI=1S/C17H14N2O4S/c20-16(18-10-9-12-5-1-3-7-14(12)18)11-19-17(21)13-6-2-4-8-15(13)24(19,22)23/h1-8H,9-11H2
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| InChIKey |
SOBFZOBFFWHUPL-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