BioLiP

PDB

BioLiP

PDB CCD ID:

A1I2Z

Number of entries in BioLiP:

Chemical formula:

C5 H5 F3 N2

InChI:

InChI=1S/C5H5F3N2/c1-3-9-2-4(10-3)5(6,7)8/h2H,1H3,(H,9,10)

InChIKey:

UTUSYSDVLOWRJA-UHFFFAOYSA-N

SMILES:

Software	SMILES
CACTVS 3.385 OpenEye OEToolkits 2.0.7	Cc1[nH]cc(n1)C(F)(F)F

Name:

2-methyl-4-(trifluoromethyl)-1~{H}-imidazole

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).