SEQ2FUN

BioLiP

PDB CCD ID: AF
Number of entries in BioLiP: 8
Chemical formula: C13 H11 N
InChI: InChI=1S/C13H11N/c14-11-5-6-13-10(8-11)7-9-3-1-2-4-12(9)13/h1-6,8H,7,14H2
InChIKey: CFRFHWQYWJMEJN-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
ACDLabs 10.04c1cccc3c1c2c(cc(N)cc2)C3
CACTVS 3.341Nc1ccc2c(Cc3ccccc23)c1
OpenEye OEToolkits 1.5.0c1ccc-2c(c1)Cc3c2ccc(c3)N
Name:2-AMINOFLUORENE
ChEMBL: CHEMBL84472
ZINC: ZINC000001516303

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).