SEQ2FUN

BioLiP

PDB CCD ID: 8IA
Number of entries in BioLiP: 2
Chemical formula: C8 H17 N
InChI: InChI=1S/C8H17N/c1-9(2)8-6-4-3-5-7-8/h8H,3-7H2,1-2H3
InChIKey: SVYKKECYCPFKGB-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
CACTVS 3.385
OpenEye OEToolkits 2.0.7		CN(C)C1CCCCC1
Name:~{N},~{N}-dimethylcyclohexanamine
ChEMBL: CHEMBL3186662
ZINC: ZINC000001640007
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).