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

7MZ

Summary
Name:1-(3-pyrimidin-2-yloxyphenyl)ethanone
Formula:C12 H10 N2 O2
Formal charge:0
Formula weight:214.22 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.61-(3-pyrimidin-2-yloxyphenyl)ethanone

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C12H10N2O2/c1-9(15)10-4-2-5-11(8-10)16-12-13-6-3-7-14-12/h2-8H,1H3
InChIKeyInChI1.03OMHNTGPQUCHKHG-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385CC(=O)c1cccc(Oc2ncccn2)c1
SMILESCACTVS3.385CC(=O)c1cccc(Oc2ncccn2)c1
SMILES_CANONICALOpenEye OEToolkits2.0.6CC(=O)c1cccc(c1)Oc2ncccn2
SMILESOpenEye OEToolkits2.0.6CC(=O)c1cccc(c1)Oc2ncccn2

219140

PDB entries from 2024-05-01

PDB statisticsPDBj update infoContact PDBjnumon