BioLiP

PDB

BioLiP

PDB CCD ID:

06C

Number of entries in BioLiP:

Chemical formula:

C H3 I

InChI:

InChI=1S/CH3I/c1-2/h1H3

InChIKey:

INQOMBQAUSQDDS-UHFFFAOYSA-N

SMILES:

Software	SMILES
ACDLabs 12.01	IC
CACTVS 3.370 OpenEye OEToolkits 1.7.0	CI

Name:

Iodomethane;
Methyl iodine

ChEMBL:

CHEMBL115849

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).