SEQ2FUN

BioLiP

PDB CCD ID: A1AY6
Number of entries in BioLiP: 2
Chemical formula: C12 H11 N O2
InChI: InChI=1S/C12H11NO2/c14-9-10-4-3-5-11(8-10)15-12-6-1-2-7-13-12/h1-8,14H,9H2
InChIKey: BXCKKTGCZQDZBY-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
ACDLabs 12.01OCc1cc(ccc1)Oc1ccccn1
CACTVS 3.385OCc1cccc(Oc2ccccn2)c1
OpenEye OEToolkits 2.0.7c1ccnc(c1)Oc2cccc(c2)CO
Name:{3-[(pyridin-2-yl)oxy]phenyl}methanol
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).