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

Obsolete: DRG

DRG was replaced with 86Q on
Summary
Name:5,6-DIHYDRO-BENZO[H]CINNOLIN-3-YLAMINE
Formula:C12 H11 N3
Formal charge:0
Formula weight:197.236 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs10.045,6-dihydrobenzo[h]cinnolin-3-amine
OpenEye OEToolkits1.5.05,6-dihydrobenzo[h]cinnolin-3-amine

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04n1nc(N)cc3c1c2ccccc2CC3
SMILES_CANONICALCACTVS3.341Nc1cc2CCc3ccccc3c2nn1
SMILESCACTVS3.341Nc1cc2CCc3ccccc3c2nn1
SMILES_CANONICALOpenEye OEToolkits1.5.0c1ccc-2c(c1)CCc3c2nnc(c3)N
SMILESOpenEye OEToolkits1.5.0c1ccc-2c(c1)CCc3c2nnc(c3)N
InChIInChI1.03InChI=1S/C12H11N3/c13-11-7-9-6-5-8-3-1-2-4-10(8)12(9)15-14-11/h1-4,7H,5-6H2,(H2,13,14)
InChIKeyInChI1.03QKVREUJWFZJEJK-UHFFFAOYSA-N

223532

PDB entries from 2024-08-07

PDB statisticsPDBj update infoContact PDBjnumon