SEQ2FUN

BioLiP

PDB CCD ID: BNZ
Number of entries in BioLiP: 9
Chemical formula: C6 H6
InChI: InChI=1S/C6H6/c1-2-4-6-5-3-1/h1-6H
InChIKey: UHOVQNZJYSORNB-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
ACDLabs 11.02
CACTVS 3.352
OpenEye OEToolkits 1.7.0		c1ccccc1
Name:BENZENE
ChEMBL: CHEMBL277500
ZINC: ZINC000000967532
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).