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BioLiP

PDB CCD ID: ACM
Number of entries in BioLiP: 4
Chemical formula: C2 H5 N O
InChI: InChI=1S/C2H5NO/c1-2(3)4/h1H3,(H2,3,4)
InChIKey: DLFVBJFMPXGRIB-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
ACDLabs 10.04O=C(N)C
CACTVS 3.341CC(N)=O
OpenEye OEToolkits 1.5.0CC(=O)N
Name:ACETAMIDE
ChEMBL: CHEMBL16081
DrugBank: DB02736
ZINC: ZINC000008034818
Reference:
  • Chengxin Zhang, Xi Zhang, Peter L 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).

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