SEQ2FUN

BioLiP

PDB CCD ID: VU9
Number of entries in BioLiP: 1
Chemical formula: C10 H14 N2
InChI: InChI=1S/C10H14N2/c1-2-4-10(5-3-1)12-8-6-11-7-9-12/h1-5,11H,6-9H2
InChIKey: YZTJYBJCZXZGCT-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
ACDLabs 12.01c1cc(ccc1)N1CCNCC1
CACTVS 3.385C1CN(CCN1)c2ccccc2
OpenEye OEToolkits 2.0.7c1ccc(cc1)N2CCNCC2
Name:1-phenylpiperazine
ChEMBL: CHEMBL9434
ZINC: ZINC000000120271
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).