SEQ2FUN

BioLiP

PDB CCD ID: 9EE
Number of entries in BioLiP: 1
Chemical formula: C6 H12 N2 O2
InChI: InChI=1S/C6H12N2O2/c7-5(9)3-1-2-4-6(8)10/h1-4H2,(H2,7,9)(H2,8,10)
InChIKey: GVNWZKBFMFUVNX-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 2.0.6C(CCC(=O)N)CC(=O)N
CACTVS 3.385NC(=O)CCCCC(N)=O
Name:adipamide
ChEMBL: CHEMBL1416640
ZINC: ZINC000001683672
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).