SEQ2FUN

BioLiP

PDB CCD ID: YC1
Number of entries in BioLiP: 1
Chemical formula: C19 H16 N2 O2
InChI: InChI=1S/C19H16N2O2/c22-13-15-10-11-18(23-15)19-16-8-4-5-9-17(16)21(20-19)12-14-6-2-1-3-7-14/h1-11,22H,12-13H2
InChIKey: OQQVFCKUDYMWGV-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 2.0.7c1ccc(cc1)Cn2c3ccccc3c(n2)c4ccc(o4)CO
CACTVS 3.385OCc1oc(cc1)c2nn(Cc3ccccc3)c4ccccc24
Name:[5-[1-(phenylmethyl)indazol-3-yl]furan-2-yl]methanol
ChEMBL: CHEMBL333985
ZINC: ZINC000001492386
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).