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BioLiP

PDB CCD ID: 9TI
Number of entries in BioLiP: 2
Chemical formula: C11 H10 N4
InChI: InChI=1S/C11H10N4/c1-8-11(9-5-6-12-14-9)15-7-3-2-4-10(15)13-8/h2-7H,1H3,(H,12,14)
InChIKey: HPJHIZQUPBRFBY-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
CACTVS 3.385Cc1nc2ccccn2c1c3[nH]ncc3
OpenEye OEToolkits 2.0.7Cc1c(n2ccccc2n1)c3ccn[nH]3
Name:2-methyl-3-(1~{H}-pyrazol-5-yl)imidazo[1,2-a]pyridine
ZINC: ZINC000000123793
Reference:
  • Chengxin Zhang, Xi Zhang, Peter L 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).

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