SEQ2FUN

BioLiP

PDB CCD ID: 8ZM
Number of entries in BioLiP: 3
Chemical formula: C10 H7 N5 O
InChI: InChI=1S/C10H7N5O/c16-9-6-8(7-4-2-1-3-5-7)11-10-12-13-14-15(9)10/h1-6,16H
InChIKey: ZEMGYOQXYFNSGE-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
ACDLabs 12.01c3(c1nc2n(c(c1)O)nnn2)ccccc3
OpenEye OEToolkits 2.0.6c1ccc(cc1)c2cc(n3c(n2)nnn3)O
CACTVS 3.385Oc1cc(nc2nnnn12)c3ccccc3
Name:5-phenyltetrazolo[1,5-a]pyrimidin-7-ol
ChEMBL: CHEMBL4065757
ZINC: ZINC000006139807
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).