BioLiP

PDB

BioLiP

PDB CCD ID:

SEA

Number of entries in BioLiP:

Chemical formula:

C2 H7 N S

InChI:

InChI=1/C2H7NS/c3-1-2-4/h4H,1-3H2

InChIKey:

UFULAYFCSOUIOV-UHFFFAOYAX

SMILES:

Software	SMILES
ACDLabs 10.04	SCCN
OpenEye OEToolkits 1.5.0	C(CS)N
CACTVS 3.341	NCCS

Name:

THIOETHYLAMINE

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).