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

DPT

Summary
Name:4,7-DIMETHYL-[1,10]PHENANTHROLINE
Formula:C14 H12 N2
Formal charge:0
Formula weight:208.258 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs10.044,7-dimethyl-1,10-phenanthroline
OpenEye OEToolkits1.5.04,7-dimethyl-1,10-phenanthroline

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04n1c3c(c(cc1)C)ccc2c(ccnc23)C
SMILES_CANONICALCACTVS3.341Cc1ccnc2c1ccc3c(C)ccnc23
SMILESCACTVS3.341Cc1ccnc2c1ccc3c(C)ccnc23
SMILES_CANONICALOpenEye OEToolkits1.5.0Cc1ccnc2c1ccc3c2nccc3C
SMILESOpenEye OEToolkits1.5.0Cc1ccnc2c1ccc3c2nccc3C
InChIInChI1.03InChI=1S/C14H12N2/c1-9-5-7-15-13-11(9)3-4-12-10(2)6-8-16-14(12)13/h3-8H,1-2H3
InChIKeyInChI1.03JIVLDFFWTQYGSR-UHFFFAOYSA-N

222415

数据于2024-07-10公开中

PDB statisticsPDBj update infoContact PDBjnumon