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BioLiP

PDB CCD ID: BMD
Number of entries in BioLiP: 8
Chemical formula: C4 H9 N O
InChI: InChI=1S/C4H9NO/c1-2-3-4(5)6/h2-3H2,1H3,(H2,5,6)
InChIKey: DNSISZSEWVHGLH-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
ACDLabs 10.04O=C(N)CCC
OpenEye OEToolkits 1.5.0CCCC(=O)N
CACTVS 3.341CCCC(N)=O
Name:BUTYRAMIDE
ChEMBL: CHEMBL1231396
DrugBank: DB02121
ZINC: ZINC000001586734
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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