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BioLiP

PDB CCD ID: Z19
Number of entries in BioLiP: 1
Chemical formula: C8 H8 N4 O
InChI: InChI=1S/C8H8N4O/c9-10-8(13)7-5-3-1-2-4-6(5)11-12-7/h1-4H,9H2,(H,10,13)(H,11,12)
InChIKey: JOUPSJAGJHYWLM-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 1.7.0c1ccc2c(c1)c(n[nH]2)C(=O)NN
CACTVS 3.370NNC(=O)c1n[nH]c2ccccc12
ACDLabs 12.01O=C(c2nnc1ccccc12)NN
Name:1H-indazole-3-carbohydrazide
ZINC: ZINC000000081541
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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