SEQ2FUN

BioLiP

PDB CCD ID: FZM
Number of entries in BioLiP: 1
Chemical formula: C12 H12 N2
InChI: InChI=1S/C12H12N2/c1-2-5-10(6-3-1)11-9-14-8-4-7-12(14)13-11/h1-3,5-6,9H,4,7-8H2
InChIKey: PPYLPCSLYXBQRM-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
CACTVS 3.385C1Cn2cc(nc2C1)c3ccccc3
ACDLabs 12.01c1cccc(c1)c2nc3n(c2)CCC3
OpenEye OEToolkits 2.0.6c1ccc(cc1)c2cn3c(n2)CCC3
Name:2-phenyl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole
ChEMBL: CHEMBL1380070
ZINC: ZINC000000241083
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).