SEQ2FUN

BioLiP

PDB CCD ID: GIQ
Number of entries in BioLiP: 2
Chemical formula: C11 H10 N4
InChI: InChI=1S/C11H10N4/c1-15-9-5-4-8-7(3-2-6-13-8)10(9)14-11(15)12/h2-6H,1H3,(H2,12,14)
InChIKey: ARZWATDYIYAUTA-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
ACDLabs 10.04n2cccc3c1nc(n(c1ccc23)C)N
CACTVS 3.341Cn1c(N)nc2c1ccc3ncccc23
OpenEye OEToolkits 1.5.0Cn1c2ccc3c(c2nc1N)cccn3
Name:3-METHYL-3H-IMIDAZO[4,5-F]QUINOLIN-2-AMINE;
2-AMINO-3-METHYLIMIDAZO[4,5-F]QUINOLINE
ChEMBL: CHEMBL1233049
ZINC: ZINC000013282307
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).