General Information of the Compound
| Compound ID |
CP0463562
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| Compound Name |
N-(2,4,6-trimethylphenyl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide
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| Structure |
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| Formula |
C17H19NO4S
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| Molecular Weight |
333.409
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| Canonical SMILES |
Cc1cc(C)c(NS(=O)(=O)c2ccc3OCCOc3c2)c(C)c1
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| InChI |
InChI=1S/C17H19NO4S/c1-11-8-12(2)17(13(3)9-11)18-23(19,20)14-4-5-15-16(10-14)22-7-6-21-15/h4-5,8-10,18H,6-7H2,1-3H3
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| InChIKey |
KBKDOQIWUMHWCS-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