General Information of the Compound
| Compound ID |
CP0543437
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| Compound Name |
1-[2,6-di(propan-2-yl)phenyl]-3-[(E)-2-(1,3-thiazol-2-yl)ethenyl]sulfonylurea
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| Structure |
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| Formula |
C18H23N3O3S2
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| Molecular Weight |
393.534
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| Canonical SMILES |
CC(C)c1cccc(C(C)C)c1NC(=O)NS(=O)(=O)\C=C\c1nccs1
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| InChI |
InChI=1S/C18H23N3O3S2/c1-12(2)14-6-5-7-15(13(3)4)17(14)20-18(22)21-26(23,24)11-8-16-19-9-10-25-16/h5-13H,1-4H3,(H2,20,21,22)/b11-8+
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| InChIKey |
MILCEDFUBXAZNY-DHZHZOJOSA-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