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BioLiP

PDB CCD ID: A7W
Number of entries in BioLiP: 1
Chemical formula: C9 H8 N2 O
InChI: InChI=1S/C9H8N2O/c10-8-3-1-2-6-4-7(12)5-11-9(6)8/h1-5,12H,10H2
InChIKey: GLVURCUKRZAGQN-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 1.7.6c1cc2cc(cnc2c(c1)N)O
CACTVS 3.385Nc1cccc2cc(O)cnc12
Name:8-AMINO-3-QUINOLINOL
ZINC: ZINC000090193149
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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