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

GQM

Summary
Name:5-methoxy-2-(1~{H}-pyrazol-3-yl)phenol
Formula:C10 H10 N2 O2
Formal charge:0
Formula weight:190.199 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.65-methoxy-2-(1~{H}-pyrazol-3-yl)phenol

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C10H10N2O2/c1-14-7-2-3-8(10(13)6-7)9-4-5-11-12-9/h2-6,13H,1H3,(H,11,12)
InChIKeyInChI1.03KCSNRNYLTIFFOZ-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385COc1ccc(c(O)c1)c2cc[nH]n2
SMILESCACTVS3.385COc1ccc(c(O)c1)c2cc[nH]n2
SMILES_CANONICALOpenEye OEToolkits2.0.6COc1ccc(c(c1)O)c2cc[nH]n2
SMILESOpenEye OEToolkits2.0.6COc1ccc(c(c1)O)c2cc[nH]n2

218196

PDB entries from 2024-04-10

PDB statisticsPDBj update infoContact PDBjnumon