SEQ2FUN

BioLiP

PDB CCD ID: FNA
Number of entries in BioLiP: 1
Chemical formula: C16 H13 N
InChI: InChI=1S/C16H13N/c1-2-9-14(10-3-1)17-16-12-6-8-13-7-4-5-11-15(13)16/h1-12,17H
InChIKey: XQVWYOYUZDUNRW-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
CACTVS 3.370N(c1ccccc1)c2cccc3ccccc23
OpenEye OEToolkits 1.7.2c1ccc(cc1)Nc2cccc3c2cccc3
ACDLabs 12.01c3c(Nc1ccccc1)c2ccccc2cc3
Name:N-phenylnaphthalen-1-amine
ChEMBL: CHEMBL170408
ZINC: ZINC000001513833
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).