General Information of Drug (ID: DMI03KV)

Drug Name
4-fluorophenyl-2,2-diphenylacetamide
Synonyms CHEMBL258604; SCHEMBL2337394
Indication
Disease Entry ICD 11 Status REF
Discovery agent N.A. Investigative [1]
Drug Type
Small molecular drug
Structure
3D MOL 2D MOL
#Ro5 Violations (Lipinski): 0 Molecular Weight (mw) 305.3
Logarithm of the Partition Coefficient (xlogp) 4
Rotatable Bond Count (rotbonds) 4
Hydrogen Bond Donor Count (hbonddonor) 1
Hydrogen Bond Acceptor Count (hbondacc) 2
Chemical Identifiers
Formula
C20H16FNO
IUPAC Name
2-(4-fluorophenyl)-2,2-diphenylacetamide
Canonical SMILES
C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=C(C=C3)F)C(=O)N
InChI
InChI=1S/C20H16FNO/c21-18-13-11-17(12-14-18)20(19(22)23,15-7-3-1-4-8-15)16-9-5-2-6-10-16/h1-14H,(H2,22,23)
InChIKey
JHPLFDBQYVMFCT-UHFFFAOYSA-N
Cross-matching ID
PubChem CID
9879550
TTD ID
D02CZC

Molecular Interaction Atlas of This Drug


Drug Therapeutic Target (DTT)
DTT Name DTT ID UniProt ID MOA REF
Calcium-activated potassium channel (KCN) TTMNI76 NOUNIPROTAC Inhibitor [1]
Molecular Interaction Atlas (MIA) Jump to Detail Molecular Interaction Atlas of This Drug

References

1 Novel inhibitors of the Gardos channel for the treatment of sickle cell disease. J Med Chem. 2008 Feb 28;51(4):976-82.