SEQ2FUN

BioLiP

PDB CCD ID: DMS
Number of entries in BioLiP: 59
Chemical formula: C2 H6 O S
InChI: InChI=1S/C2H6OS/c1-4(2)3/h1-2H3
InChIKey: IAZDPXIOMUYVGZ-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
CACTVS 3.341C[S](C)=O
ACDLabs 10.04sulfinyldimethane
OpenEye OEToolkits 1.5.0CS(=O)C
Name:DIMETHYL SULFOXIDE
ChEMBL: CHEMBL504
DrugBank: DB01093
ZINC: ZINC000005224188
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).