DISOPYRAMIDE

Search structure
Synonyms:
Status: Approved (1977)
Entry Type: Small molecule
Molecule Category: Parent
ATC: C01BA03
UNII: GFO928U8MQ

Structure
InChI Key UVTNFZQICZKOEM-UHFFFAOYSA-N
Smile CC(C)N(CCC(C(N)=O)(c1ccccc1)c1ccccn1)C(C)C
InChI
InChI=1S/C21H29N3O/c1-16(2)24(17(3)4)15-13-21(20(22)25,18-10-6-5-7-11-18)19-12-8-9-14-23-19/h5-12,14,16-17H,13,15H2,1-4H3,(H2,22,25)

Physicochemical Descriptors

Property Name Value
Molecular Formula C21H29N3O
Molecular Weight 339.48
AlogP 3.36
Hydrogen Bond Acceptor 3.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 8.0
Polar Surface Area 59.22
Molecular species BASE
Aromatic Rings 2.0
Heavy Atoms 25.0

Pharmacology

Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Enzyme Hydrolase
- - - - -27.21--5.201
Enzyme Transferase
- - - - 26.69
Ion channel Voltage-gated ion channel Potassium channels Voltage-gated potassium channel
- 12000-91201.08 - - -
Ion channel Voltage-gated ion channel Voltage-gated calcium channel
- 1036700 - - -
Ion channel Voltage-gated ion channel Voltage-gated sodium channel
- - - - 17
Membrane receptor Family A G protein-coupled receptor Small molecule receptor (family A GPCR) Monoamine receptor Acetylcholine receptor
- - - - -1-7
Transporter Electrochemical transporter SLC superfamily of solute carriers SLC21/SLCO family of organic anion transporting polypeptides
- - - - 18.5
Transporter Electrochemical transporter SLC superfamily of solute carriers SLC22 family of organic cation and anion transporters
- 2900 - 30000 68.8
Transporter Electrochemical transporter SLC superfamily of solute carriers SLC47 family of multidrug and toxin extrusion transporters
- 66000 - - -

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Atrial Fibrillation 3 D001281 ClinicalTrials
Heart Failure 3 D006333 ClinicalTrials

Related Entries

Scaffolds

Salt

Cross References

Resources Reference
CAS NUMBER 3737-09-5
ChEBI 4657
ChEMBL CHEMBL517
DrugBank DB00280
DrugCentral 926
EPA CompTox DTXSID1045536
FDA SRS GFO928U8MQ
Human Metabolome Database HMDB14425
Guide to Pharmacology 7167
KEGG C06965
PharmGKB PA449373
PubChem 3114
SureChEMBL SCHEMBL23931452
CONTENTS