BioLiP

PDB

BioLiP

PDB CCD ID:

UAE

Number of entries in BioLiP:

Chemical formula:

C13 H24 N2 O

InChI:

InChI=1S/C13H24N2O/c1-11-7-9-15(10-8-11)13(16)14-12-5-3-2-4-6-12/h11-12H,2-10H2,1H3,(H,14,16)

InChIKey:

BOSHLBWKQSSSGD-UHFFFAOYSA-N

SMILES:

Software	SMILES
CACTVS 3.385 OpenEye OEToolkits 2.0.7	CC1CCN(CC1)C(=O)NC2CCCCC2

Name:

~{N}-cyclohexyl-4-methyl-piperidine-1-carboxamide

ZINC:

ZINC000005915794

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).