SEQ2FUN

BioLiP

PDB CCD ID: IRU
Number of entries in BioLiP: 6
Chemical formula: C4 H6 N2 O
InChI: InChI=1S/C4H6N2O/c7-3-4-1-2-5-6-4/h1-2,7H,3H2,(H,5,6)
InChIKey: UIEABCXJWANXFS-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
CACTVS 3.385OCc1[nH]ncc1
OpenEye OEToolkits 2.0.7c1cn[nH]c1CO
Name:1~{H}-pyrazol-5-ylmethanol
ChEMBL: CHEMBL3275945
ZINC: ZINC000004343992
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).