SEQ2FUN

BioLiP

PDB CCD ID: QI6
Number of entries in BioLiP: 2
Chemical formula: C10 H8 N4
InChI: InChI=1S/C10H8N4/c11-10-8-4-2-1-3-7(8)9-5-6-12-14(9)13-10/h1-6H,(H2,11,13)
InChIKey: VOLKDTKFDOIYJN-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 2.0.7c1ccc2c(c1)c3ccnn3nc2N
CACTVS 3.385Nc1nn2nccc2c3ccccc13
Name:pyrazolo[5,1-a]phthalazin-6-amine
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).