SEQ2FUN

BioLiP

PDB CCD ID: BU8
Number of entries in BioLiP: 11
Chemical formula: C6 H6 N4
InChI: InChI=1S/C6H6N4/c7-6-9-4-2-1-3-8-5(4)10-6/h1-3H,(H3,7,8,9,10)
InChIKey: KXQPVJRJUJJWQJ-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
CACTVS 3.385Nc1[nH]c2cccnc2n1
OpenEye OEToolkits 2.0.6c1cc2c(nc1)nc([nH]2)N
Name:1~{H}-imidazo[4,5-b]pyridin-2-amine
ChEMBL: CHEMBL4589188
ZINC: ZINC000017060146
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).