BioLiP

PDB

BioLiP

PDB CCD ID:

GWP

Number of entries in BioLiP:

Chemical formula:

C7 H9 N3 O

InChI:

InChI=1S/C7H9N3O/c8-6(11)5-3-9-7(10-5)4-1-2-4/h3-4H,1-2H2,(H2,8,11)(H,9,10)

InChIKey:

ZIJDZTAYMWKMQH-UHFFFAOYSA-N

SMILES:

Software	SMILES
CACTVS 3.385	NC(=O)c1c[nH]c(n1)C2CC2
OpenEye OEToolkits 2.0.6	c1c(nc([nH]1)C2CC2)C(=O)N

Name:

2-cyclopropyl-1~{H}-imidazole-4-carboxamide

ZINC:

ZINC000074942043

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).