BioLiP

PDB

BioLiP

PDB CCD ID:

Z3V

Number of entries in BioLiP:

Chemical formula:

C4 H11 N S

InChI:

InChI=1S/C4H11NS/c1-2-5-3-4-6/h5-6H,2-4H2,1H3

InChIKey:

KMTRYVQPHVFAFJ-UHFFFAOYSA-N

SMILES:

Software	SMILES
ACDLabs 12.01 CACTVS 3.385 OpenEye OEToolkits 2.0.7	CCNCCS

Name:

2-(ethylamino)ethane-1-thiol

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).