SEQ2FUN

BioLiP

PDB CCD ID: 7FU
Number of entries in BioLiP: 2
Chemical formula: C8 H9 N5 O S
InChI: InChI=1S/C8H9N5OS/c9-12-7(14)4-1-2-5-6(3-4)15-8(11-5)13-10/h1-3H,9-10H2,(H,11,13)(H,12,14)
InChIKey: JTWKTGKIUURTLG-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 2.0.6c1cc2c(cc1C(=O)NN)sc(n2)NN
CACTVS 3.385NNC(=O)c1ccc2nc(NN)sc2c1
Name:2-Hydrazino-1,3-benzothiazole-6-carbohydrazide
ChEMBL: CHEMBL3092385
ZINC: ZINC000008729882
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).