SEQ2FUN

BioLiP

PDB CCD ID: 9BS
Number of entries in BioLiP: 4
Chemical formula: C9 H7 N3
InChI: InChI=1S/C9H7N3/c1-2-5-10-8(4-1)9-11-6-3-7-12-9/h1-7H
InChIKey: YJVKLLJCUMQBHN-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
ACDLabs 12.01n2c(c1ncccc1)nccc2
OpenEye OEToolkits 2.0.6c1ccnc(c1)c2ncccn2
CACTVS 3.385c1ccc(nc1)c2ncccn2
Name:2-(pyridin-2-yl)pyrimidine
ZINC: ZINC000038482087
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).