General Information of Drug (ID: DMBRL19)

Drug Name
Bimakalim
Synonyms EMD-52692; SR-44866
Indication
Disease Entry ICD 11 Status REF
Angina pectoris BA40 Phase 2 [1]
Drug Type
Small molecular drug
Structure
3D MOL 2D MOL
#Ro5 Violations (Lipinski): 0 Molecular Weight (mw) 278.3
Logarithm of the Partition Coefficient (xlogp) 2.3
Rotatable Bond Count (rotbonds) 1
Hydrogen Bond Donor Count (hbonddonor) 0
Hydrogen Bond Acceptor Count (hbondacc) 3
Chemical Identifiers
Formula
C17H14N2O2
IUPAC Name
2,2-dimethyl-4-(2-oxopyridin-1-yl)chromene-6-carbonitrile
Canonical SMILES
CC1(C=C(C2=C(O1)C=CC(=C2)C#N)N3C=CC=CC3=O)C
InChI
InChI=1S/C17H14N2O2/c1-17(2)10-14(19-8-4-3-5-16(19)20)13-9-12(11-18)6-7-15(13)21-17/h3-10H,1-2H3
InChIKey
JTVSKASWNROQQF-UHFFFAOYSA-N
Cross-matching ID
PubChem CID
60674
CAS Number
117545-11-6
TTD ID
D01ISE

Molecular Interaction Atlas of This Drug


Drug Therapeutic Target (DTT)
DTT Name DTT ID UniProt ID MOA REF
Potassium channel unspecific (KC) TT1VOHK NOUNIPROTAC Agonist [1]
Molecular Interaction Atlas (MIA) Jump to Detail Molecular Interaction Atlas of This Drug

References

1 Lack of anti-ischemic efficacy of the potassium channel opener bimakalim in patients with stable angina pectoris. Cardiovasc Drugs Ther. 2004 Jan;18(1):37-46.