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BioLiP

PDB CCD ID: DA9
Number of entries in BioLiP: 1
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:
SoftwareSMILES
CACTVS 3.352SCCNC(=O)CN=[N+]=[N-]
OpenEye OEToolkits 1.7.0C(CS)NC(=O)CN=[N+]=[N-]
Name:2-azido-N-(2-sulfanylethyl)ethanamide
ZINC: ZINC000058631990
Reference:
  • Chengxin Zhang, Xi Zhang, Peter L 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).

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