SEQ2FUN

BioLiP

PDB CCD ID: UYY
Number of entries in BioLiP: 3
Chemical formula: C8 H9 N O2
InChI: InChI=1S/C8H9NO2/c1-11-7-5-3-2-4-6(7)8(9)10/h2-5H,1H3,(H2,9,10)
InChIKey: MNWSGMTUGXNYHJ-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 2.0.7COc1ccccc1C(=O)N
ACDLabs 12.01
CACTVS 3.385		COc1ccccc1C(N)=O
Name:2-methoxybenzamide
ChEMBL: CHEMBL2436421
ZINC: ZINC000000410136
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).