BioLiP

PDB

BioLiP

PDB CCD ID:

QFT

Number of entries in BioLiP:

Chemical formula:

C6 H4 F N O3

InChI:

InChI=1S/C6H4FNO3/c7-5-2-1-4(8(10)11)3-6(5)9/h1-3,9H

InChIKey:

WFRLFZAMCVAQLN-UHFFFAOYSA-N

SMILES:

Software	SMILES
CACTVS 3.385	Oc1cc(ccc1F)[N](=O)=O
OpenEye OEToolkits 2.0.7	c1cc(c(cc1N(=O)=O)O)F

Name:

2-fluoranyl-5-nitro-phenol

ZINC:

ZINC000014007835

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).