Drug Information

Drug General Information
Drug ID
D01IWD
Former ID
DNC004414
Drug Name
MDL-74156
Drug Type
Small molecular drug
Indication Discovery agent Investigative [526678]
Formula
C19H22N2O3
Canonical SMILES
C1C2CC3CC(CC1N3CC2O)OC(=O)C4=CNC5=CC=CC=C54
InChI
1S/C19H22N2O3/c22-18-10-21-12-5-11(18)6-13(21)8-14(7-12)24-19(23)16-9-20-17-4-2-1-3-15(16)17/h1-4,9,11-14,18,20,22H,5-8,10H2
InChIKey
MLWGAEVSWJXOQJ-UHFFFAOYSA-N
PubChem Compound ID
159502
PubChem Substance ID
10253632, 14924134, 46234745, 50064312, 74740493, 103097086, 103097087, 103620561, 113442549, 117554862, 126444236, 128614576, 135115489, 162385093, 162784128, 163361195, 232915935
Target and Pathway
Target(s) Potassium voltage-gated channel subfamily H member 2 Target Info Inhibitor [526678]
PathWhiz Pathway Muscle/Heart Contraction
Reactome Voltage gated Potassium channels
WikiPathways SIDS Susceptibility Pathways
Hematopoietic Stem Cell Differentiation
Potassium Channels
References
Ref 526678Bioorg Med Chem Lett. 2003 Aug 18;13(16):2773-5.Prediction of hERG potassium channel affinity by traditional and hologram qSAR methods.
Ref 526678Bioorg Med Chem Lett. 2003 Aug 18;13(16):2773-5.Prediction of hERG potassium channel affinity by traditional and hologram qSAR methods.

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