SEQ2FUN

BioLiP

PDB CCD ID: A1AB0
Number of entries in BioLiP: 1
Chemical formula: C11 H10 N2
InChI: InChI=1S/C11H10N2/c12-10-6-7-13-11(8-10)9-4-2-1-3-5-9/h1-8H,(H2,12,13)
InChIKey: CHVKPWIABFICLK-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
CACTVS 3.385Nc1ccnc(c1)c2ccccc2
ACDLabs 12.01Nc1ccnc(c1)c1ccccc1
OpenEye OEToolkits 2.0.7c1ccc(cc1)c2cc(ccn2)N
Name:2-phenylpyridin-4-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).