SEQ2FUN

BioLiP

PDB CCD ID: 5G1
Number of entries in BioLiP: 2
Chemical formula: C7 H7 Cl N2 O
InChI: InChI=1S/C7H7ClN2O/c8-6-4-2-1-3-5(6)7(11)10-9/h1-4H,9H2,(H,10,11)
InChIKey: KPPNLSKVTKSSTG-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
CACTVS 3.385NNC(=O)c1ccccc1Cl
OpenEye OEToolkits 1.9.2c1ccc(c(c1)C(=O)NN)Cl
ACDLabs 12.01c1(ccccc1Cl)C(=O)NN
Name:2-chlorobenzohydrazide
ChEMBL: CHEMBL3237995
ZINC: ZINC000000152501
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).