Details
Stereochemistry | ACHIRAL |
Molecular Formula | C9H4Cl2O2S |
Molecular Weight | 247.098 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)C1=C(Cl)C2=C(S1)C=C(Cl)C=C2
InChI
InChIKey=AAHPIJMQJAZYTM-UHFFFAOYSA-N
InChI=1S/C9H4Cl2O2S/c10-4-1-2-5-6(3-4)14-8(7(5)11)9(12)13/h1-3H,(H,12,13)
Molecular Formula | C9H4Cl2O2S |
Molecular Weight | 247.098 |
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: O14874 Gene ID: 10295.0 Gene Symbol: BCKDK Target Organism: Homo sapiens (Human) Sources: https://www.ncbi.nlm.nih.gov/pubmed/24895126 |
3.19 µM [IC50] |
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 15:35:27 GMT 2023
by
admin
on
Sat Dec 16 15:35:27 GMT 2023
|
Record UNII |
D6H647726W
|
Record Status |
Validated (UNII)
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Record Version |
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-
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739884
Created by
admin on Sat Dec 16 15:35:27 GMT 2023 , Edited by admin on Sat Dec 16 15:35:27 GMT 2023
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D6H647726W
Created by
admin on Sat Dec 16 15:35:27 GMT 2023 , Edited by admin on Sat Dec 16 15:35:27 GMT 2023
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PRIMARY |
Related Record | Type | Details | ||
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TARGET -> INHIBITOR |
IC50
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