Loading
PDBj
MenuPDBj@FacebookPDBj@X(formerly Twitter)PDBj@BlueSkyPDBj@YouTubewwPDB FoundationwwPDBDonate
RCSB PDBPDBeBMRBAdv. SearchSearch help

TE7

Summary
Name:5-{[2-(dimethylamino)ethyl]amino}-8-methoxy-6H-imidazo[4,5,1-de]acridin-6-one
Formula:C19 H20 N4 O2
Formal charge:0
Formula weight:336.388 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.015-{[2-(dimethylamino)ethyl]amino}-8-methoxy-6H-imidazo[4,5,1-de]acridin-6-one

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01O=C2c1c(ccc(OC)c1)n3c4c2c(NCCN(C)C)ccc4nc3
InChIInChI1.03InChI=1S/C19H20N4O2/c1-22(2)9-8-20-14-5-6-15-18-17(14)19(24)13-10-12(25-3)4-7-16(13)23(18)11-21-15/h4-7,10-11,20H,8-9H2,1-3H3
InChIKeyInChI1.03NJTQMNXHSDDMHX-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.370COc1ccc2n3cnc4ccc(NCCN(C)C)c(C(=O)c2c1)c34
SMILESCACTVS3.370COc1ccc2n3cnc4ccc(NCCN(C)C)c(C(=O)c2c1)c34
SMILES_CANONICALOpenEye OEToolkits1.7.2CN(C)CCNc1ccc2c3c1C(=O)c4cc(ccc4-n3cn2)OC
SMILESOpenEye OEToolkits1.7.2CN(C)CCNc1ccc2c3c1C(=O)c4cc(ccc4-n3cn2)OC

250835

PDB entries from 2026-03-18

PDB statisticsPDBj update infoContact PDBjnumon