SEQ2FUN

BioLiP

PDB CCD ID: L8H
Number of entries in BioLiP: 0
Chemical formula: C11 H11 N O
InChI: InChI=1S/C11H11NO/c1-13-11-7-9(12)6-8-4-2-3-5-10(8)11/h2-7H,12H2,1H3
InChIKey: SFKZPTYRENGBTJ-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 1.7.0COc1cc(cc2c1cccc2)N
CACTVS 3.370COc1cc(N)cc2ccccc12
ACDLabs 12.01O(c2cc(cc1ccccc12)N)C
Name:4-methoxynaphthalen-2-amine
ZINC: ZINC000000403090
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).