BioLiP

PDB

BioLiP

PDB CCD ID:

F69

Number of entries in BioLiP:

Chemical formula:

C11 H10 O S

InChI:

InChI=1S/C11H10OS/c12-8-9-4-1-2-5-10(9)11-6-3-7-13-11/h1-7,12H,8H2

InChIKey:

IUULMJAEIKVTKZ-UHFFFAOYSA-N

SMILES:

Software	SMILES
OpenEye OEToolkits 1.7.0	c1ccc(c(c1)CO)c2cccs2
ACDLabs 12.01 CACTVS 3.370	OCc1ccccc1c2sccc2

Name:

(2-thiophen-2-ylphenyl)methanol

ZINC:

ZINC000004200679

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).