Loading
PDBj
MenuPDBj@FacebookPDBj@TwitterPDBj@YouTubewwPDB FoundationwwPDB
RCSB PDBPDBeBMRBAdv. SearchSearch help

9AD

Summary
Name:9-AMINO-(N-(2-DIMETHYLAMINO)ETHYL)ACRIDINE-4-CARBOXAMIDE
Formula:C18 H20 N4 O
Formal charge:0
Formula weight:308.378 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs10.049-amino-N-[2-(dimethylamino)ethyl]acridine-4-carboxamide
OpenEye OEToolkits1.5.09-amino-N-(2-dimethylaminoethyl)acridine-4-carboxamide

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04O=C(c2cccc1c(c3c(nc12)cccc3)N)NCCN(C)C
SMILES_CANONICALCACTVS3.341CN(C)CCNC(=O)c1cccc2c(N)c3ccccc3nc12
SMILESCACTVS3.341CN(C)CCNC(=O)c1cccc2c(N)c3ccccc3nc12
SMILES_CANONICALOpenEye OEToolkits1.5.0CN(C)CCNC(=O)c1cccc2c1nc3ccccc3c2N
SMILESOpenEye OEToolkits1.5.0CN(C)CCNC(=O)c1cccc2c1nc3ccccc3c2N
InChIInChI1.03InChI=1S/C18H20N4O/c1-22(2)11-10-20-18(23)14-8-5-7-13-16(19)12-6-3-4-9-15(12)21-17(13)14/h3-9H,10-11H2,1-2H3,(H2,19,21)(H,20,23)
InChIKeyInChI1.03YLGMVQJPGUHTRO-UHFFFAOYSA-N

225158

PDB entries from 2024-09-18

PDB statisticsPDBj update infoContact PDBjnumon