BioLiP

PDB

BioLiP

PDB CCD ID:

16M

Number of entries in BioLiP:

Chemical formula:

C8 H10 S

InChI:

InChI=1S/C8H10S/c1-2-9-8-6-4-3-5-7-8/h3-7H,2H2,1H3

InChIKey:

AEHWKBXBXYNPCX-UHFFFAOYSA-N

SMILES:

Software	SMILES
	sulfide
CACTVS 3.370 OpenEye OEToolkits 1.7.6	CCSc1ccccc1

Name:

(ethylsulfanyl)benzene;
ethy lphenyl sulfide

ZINC:

ZINC000001674079

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).