BioLiP

PDB

BioLiP

PDB CCD ID:

A1EHG

Number of entries in BioLiP:

Chemical formula:

C8 H8 F N O

InChI:

InChI=1S/C8H8FNO/c1-6(11)10-8-5-3-2-4-7(8)9/h2-5H,1H3,(H,10,11)

InChIKey:

AUZPZBPZWHEIDY-UHFFFAOYSA-N

SMILES:

Software	SMILES
CACTVS 3.385 OpenEye OEToolkits 2.0.7	CC(=O)Nc1ccccc1F

Name:

~{N}-(2-fluorophenyl)ethanamide

ChEMBL:

CHEMBL121805

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).