BioLiP

PDB

BioLiP

PDB CCD ID:

DA9

Number of entries in BioLiP:

Chemical formula:

C4 H8 N4 O S

InChI:

InChI=1S/C4H8N4OS/c5-8-7-3-4(9)6-1-2-10/h10H,1-3H2,(H,6,9)

InChIKey:

JSHBGIMPVAGZMY-UHFFFAOYSA-N

SMILES:

Software	SMILES
CACTVS 3.352	SCCNC(=O)CN=[N+]=[N-]
OpenEye OEToolkits 1.7.0	C(CS)NC(=O)CN=[N+]=[N-]

Name:

2-azido-N-(2-sulfanylethyl)ethanamide

ZINC:

ZINC000058631990

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).