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BioLiP

PDB CCD ID: A1IWS
Number of entries in BioLiP: 1
Chemical formula: C3 H5 N3 O
InChI: InChI=1S/C3H5N3O/c4-2-1-3(7)6-5-2/h1H,(H4,4,5,6,7)
InChIKey: QZBGOTVBHYKUDS-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
CACTVS 3.385NC1=CC(=O)NN1
OpenEye OEToolkits 2.0.7C1=C(NNC1=O)N
Name:5-azanyl-1,2-dihydropyrazol-3-one
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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