BioLiP

PDB

BioLiP

PDB CCD ID:

PTF

Number of entries in BioLiP:

Chemical formula:

C8 H10 S

InChI:

InChI=1S/C8H10S/c1-9-7-8-5-3-2-4-6-8/h2-6H,7H2,1H3

InChIKey:

OFQPKKGMNWASPN-UHFFFAOYSA-N

SMILES:

Software	SMILES
CACTVS 3.341 OpenEye OEToolkits 1.5.0	CSCc1ccccc1
	sulfide

Name:

[(METHYLSULFANYL)METHYL]BENZENE

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).