SEQ2FUN

BioLiP

PDB CCD ID: A1CT0
Number of entries in BioLiP: 0
Chemical formula: C7 H6 F N O
InChI: InChI=1S/C7H6FNO/c8-6-4-2-1-3-5(6)7(9)10/h1-4H,(H2,9,10)
InChIKey: KGGHWIKBOIQEAJ-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 3.1.0.0c1ccc(c(c1)C(=O)N)F
CACTVS 3.385NC(=O)c1ccccc1F
ACDLabs 14.52O=C(N)c1ccccc1F
Name:2-fluorobenzamide
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).