SEQ2FUN

BioLiP

PDB CCD ID: ES1
Number of entries in BioLiP: 6
Chemical formula: C9 H7 N O
InChI: InChI=1S/C9H7NO/c11-9-5-6-10-8-4-2-1-3-7(8)9/h1-6H,(H,10,11)
InChIKey: PMZDQRJGMBOQBF-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 1.7.0c1ccc2c(c1)c(ccn2)O
CACTVS 3.352Oc1ccnc2ccccc12
Name:quinolin-4-ol
ChEMBL: CHEMBL1232567
ZINC: ZINC000008579890
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).