SEQ2FUN

BioLiP

PDB CCD ID: A1I3J
Number of entries in BioLiP: 3
Chemical formula: C10 H11 N3 O
InChI: InChI=1S/C10H11N3O/c14-8-10-7-13(12-11-10)6-9-4-2-1-3-5-9/h1-5,7,14H,6,8H2
InChIKey: SXNXKULRKDCYLM-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 2.0.7c1ccc(cc1)Cn2cc(nn2)CO
CACTVS 3.385OCc1cn(Cc2ccccc2)nn1
Name:[1-(phenylmethyl)-1,2,3-triazol-4-yl]methanol
ChEMBL: CHEMBL403608
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).