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

BY4

Summary
Name:(3R)-3-azanyl-4-methyl-1,3-dihydroindol-2-one
Formula:C9 H10 N2 O
Formal charge:0
Formula weight:162.188 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits1.7.6(3R)-3-azanyl-4-methyl-1,3-dihydroindol-2-one

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C9H10N2O/c1-5-3-2-4-6-7(5)8(10)9(12)11-6/h2-4,8H,10H2,1H3,(H,11,12)/t8-/m1/s1
InChIKeyInChI1.03DXMQUOQQGLIRSR-MRVPVSSYSA-N
SMILES_CANONICALCACTVS3.385Cc1cccc2NC(=O)[C@H](N)c12
SMILESCACTVS3.385Cc1cccc2NC(=O)[CH](N)c12
SMILES_CANONICALOpenEye OEToolkits1.7.6Cc1cccc2c1[C@H](C(=O)N2)N
SMILESOpenEye OEToolkits1.7.6Cc1cccc2c1C(C(=O)N2)N

248636

PDB entries from 2026-02-04

PDB statisticsPDBj update infoContact PDBjnumon