Details
Stereochemistry | ACHIRAL |
Molecular Formula | C13H18N2O5S |
Molecular Weight | 314.357 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
CS(=O)(=O)NC1=CC=C(C=C1OC2CCCCC2)[N+]([O-])=O
InChI
InChIKey=KTDZCOWXCWUPEO-UHFFFAOYSA-N
InChI=1S/C13H18N2O5S/c1-21(18,19)14-12-8-7-10(15(16)17)9-13(12)20-11-5-3-2-4-6-11/h7-9,11,14H,2-6H2,1H3
Molecular Formula | C13H18N2O5S |
Molecular Weight | 314.357 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Approval Year
Targets
Primary Target | Pharmacology | Condition | Potency |
---|---|---|---|
Target ID: CHEMBL230 Sources: https://www.ncbi.nlm.nih.gov/pubmed/18063374 |
0.61 µM [IC50] |
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 19:16:24 GMT 2023
by
admin
on
Sat Dec 16 19:16:24 GMT 2023
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Record UNII |
9SP55KM2KS
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Record Status |
Validated (UNII)
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Record Version |
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-
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9SP55KM2KS
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DTXSID8041084
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NS-398
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123653-11-2
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4553
Created by
admin on Sat Dec 16 19:16:24 GMT 2023 , Edited by admin on Sat Dec 16 19:16:24 GMT 2023
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Related Record | Type | Details | ||
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TARGET -> INHIBITOR |
IC50
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TARGET -> INHIBITOR |
IC50
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