SEQ2FUN

BioLiP

PDB CCD ID: HH6
Number of entries in BioLiP: 1
Chemical formula: C13 H10 N2 O2
InChI: InChI=1S/C13H10N2O2/c16-9-3-1-8(2-4-9)13-11-6-5-10(17)7-12(11)14-15-13/h1-7,16-17H,(H,14,15)
InChIKey: MUAYFXCYAHFDBS-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 1.7.6c1cc(ccc1c2c3ccc(cc3[nH]n2)O)O
CACTVS 3.370Oc1ccc(cc1)c2n[nH]c3cc(O)ccc23
ACDLabs 12.01n2c(c1ccc(O)cc1n2)c3ccc(O)cc3
Name:3-(4-hydroxyphenyl)-1H-indazol-6-ol
ChEMBL: CHEMBL2042885
ZINC: ZINC000084722807
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).