Details of the Drug

General Information of Drug (ID: DM73PXI)

Drug Name
N,N-Dimethyl-2-(2-phenyl-1H-indol-3-yl)-acetamide
Synonyms CHEMBL320626; N,N-Dimethyl-2-(2-phenyl-1H-indol-3-yl)-acetamide; BDBM50045869
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) 278.3
Logarithm of the Partition Coefficient (xlogp) 3.1
Rotatable Bond Count (rotbonds) 3
Hydrogen Bond Donor Count (hbonddonor) 1
Hydrogen Bond Acceptor Count (hbondacc) 1
Chemical Identifiers
Formula
C18H18N2O
IUPAC Name
N,N-dimethyl-2-(2-phenyl-1H-indol-3-yl)acetamide
Canonical SMILES
CN(C)C(=O)CC1=C(NC2=CC=CC=C21)C3=CC=CC=C3
InChI
InChI=1S/C18H18N2O/c1-20(2)17(21)12-15-14-10-6-7-11-16(14)19-18(15)13-8-4-3-5-9-13/h3-11,19H,12H2,1-2H3
InChIKey
RVPIQASKQHYEBT-UHFFFAOYSA-N
Cross-matching ID
PubChem CID
10446279
TTD ID
D05CYJ

Molecular Interaction Atlas of This Drug


Drug Therapeutic Target (DTT)
DTT Name DTT ID UniProt ID MOA REF
Translocator protein (TSPO) TTPTXIN TSPO_HUMAN Inhibitor [1]
Molecular Interaction Atlas (MIA) Jump to Detail Molecular Interaction Atlas of This Drug

References

1 Chemistry, binding affinities, and behavioral properties of a new class of "antineophobic" mitochondrial DBI receptor complex (mDRC) ligands. J Med Chem. 1993 Oct 1;36(20):2908-20.