SEQ2FUN

BioLiP

PDB CCD ID: I2I
Number of entries in BioLiP: 4
Chemical formula: I2
InChI: InChI=1S/I2/c1-2
InChIKey: PNDPGZBMCMUPRI-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
ACDLabs 12.01
CACTVS 3.385
OpenEye OEToolkits 1.7.6		II
Name:molecular iodine
ChEMBL: CHEMBL1201225
DrugBank: DB05382
Reference:
  • Chengxin Zhang, Xi Zhang, Lydia Freddolino, and Yang Zhang. BioLiP2: an updated structure database for biologically relevent ligand-protein interactions, Nucleic Acids Research, gkad630 (2023).
  • Jianyi Yang, Ambrish Roy, and Yang Zhang. BioLiP: a semi-manually curated database for biologically relevant ligand-protein interactions, Nucleic Acids Research, 41: D1096-D1103 (2013) (download the PDF file).