SEQ2FUN

BioLiP

PDB CCD ID: 8SF
Number of entries in BioLiP: 1
Chemical formula: C10 H12 N4 S
InChI: InChI=1S/C10H12N4S/c1-8(2)15-10-11-12-13-14(10)9-6-4-3-5-7-9/h3-8H,1-2H3
InChIKey: SRXNAOIEUJQDHS-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
CACTVS 3.385
OpenEye OEToolkits 2.0.6		CC(C)Sc1nnnn1c2ccccc2
Name:1-phenyl-5-propan-2-ylsulfanyl-1,2,3,4-tetrazole
ChEMBL: CHEMBL4574783
ZINC: ZINC000000242223
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).