SEQ2FUN

BioLiP

PDB CCD ID: 9AP
Number of entries in BioLiP: 2
Chemical formula: C14 H11 N
InChI: InChI=1S/C14H11N/c15-14-9-10-5-1-2-6-11(10)12-7-3-4-8-13(12)14/h1-9H,15H2
InChIKey: KIHQWOBUUIPWAN-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 1.5.0c1ccc2c(c1)cc(c3c2cccc3)N
CACTVS 3.341Nc1cc2ccccc2c3ccccc13
ACDLabs 10.04c23c1ccccc1cc(N)c2cccc3
Name:9-AMINOPHENANTHRENE
ChEMBL: CHEMBL83088
DrugBank: DB03369
ZINC: ZINC000001509324
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).