SOTALOL

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Synonyms
Status
Molecule Category Free-form
ATC C07AA07
UNII A6D97U294I
EPA CompTox DTXSID0023589

Structure

InChI Key ZBMZVLHSJCTVON-UHFFFAOYSA-N
Smiles CC(C)NCC(O)c1ccc(NS(C)(=O)=O)cc1
InChI
InChI=1S/C12H20N2O3S/c1-9(2)13-8-12(15)10-4-6-11(7-5-10)14-18(3,16)17/h4-7,9,12-15H,8H2,1-3H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C12H20N2O3S
Molecular Weight 272.37
AlogP 1.09
Hydrogen Bond Acceptor 4.0
Hydrogen Bond Donor 3.0
Number of Rotational Bond 6.0
Polar Surface Area 78.43
Molecular species BASE
Aromatic Rings 1.0
Heavy Atoms 18.0

Pharmacology

Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Ion channel Voltage-gated ion channel Voltage-gated sodium channel
- - - - 0-4.6
Membrane receptor Family A G protein-coupled receptor Small molecule receptor (family A GPCR) Monoamine receptor Adrenergic receptor
- - 580 - -
Transporter Electrochemical transporter SLC superfamily of solute carriers SLC21/SLCO family of organic anion transporting polypeptides
- - - - 6.6-46.4
Transporter Electrochemical transporter SLC superfamily of solute carriers SLC22 family of organic cation and anion transporters
- - - - 31.8
EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Cavia porcellus
- - 158.49 - 4.6-8
Felis catus
- - - - 85
Homo sapiens
- - - - 2.1-46.4
Rattus norvegicus
- - - - 0

Environmental Exposure

Environmental Exposure Map
Countries
Croatia
Czech Republic
Germany
Hungary
Romania
Serbia
Slovakia
Slovenia

Cross References

Resources Reference
ChEBI 63622
ChEMBL CHEMBL471
DrugBank DB00489
DrugCentral 2464
FDA SRS A6D97U294I
Human Metabolome Database HMDB0014632
Guide to Pharmacology 7297
KEGG C07309
PharmGKB PA451457
PubChem 5253
SureChEMBL SCHEMBL16407
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