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

5B2

Summary
Name:5-phenyl-1H-indazol-3-amine
Formula:C13 H11 N3
Formal charge:0
Formula weight:209.247 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs10.045-phenyl-1H-indazol-3-amine
OpenEye OEToolkits1.5.05-phenyl-1H-indazol-3-amine

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04n2c(c1cc(ccc1n2)c3ccccc3)N
SMILES_CANONICALCACTVS3.341Nc1n[nH]c2ccc(cc12)c3ccccc3
SMILESCACTVS3.341Nc1n[nH]c2ccc(cc12)c3ccccc3
SMILES_CANONICALOpenEye OEToolkits1.5.0c1ccc(cc1)c2ccc3c(c2)c(n[nH]3)N
SMILESOpenEye OEToolkits1.5.0c1ccc(cc1)c2ccc3c(c2)c(n[nH]3)N
InChIInChI1.03InChI=1S/C13H11N3/c14-13-11-8-10(6-7-12(11)15-16-13)9-4-2-1-3-5-9/h1-8H,(H3,14,15,16)
InChIKeyInChI1.03ZCUSNQPYUNLATP-UHFFFAOYSA-N

222926

PDB entries from 2024-07-24

PDB statisticsPDBj update infoContact PDBjnumon