SEQ2FUN

BioLiP

PDB CCD ID: 7WG
Number of entries in BioLiP: 1
Chemical formula: C6 H9 N3
InChI: InChI=1S/C6H9N3/c7-6-8-3-5(9-6)4-1-2-4/h3-4H,1-2H2,(H3,7,8,9)
InChIKey: LHDVWRMWQJIACV-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
ACDLabs 12.01c1nc(nc1C2CC2)N
OpenEye OEToolkits 2.0.6c1c([nH]c(n1)N)C2CC2
CACTVS 3.385Nc1[nH]c(cn1)C2CC2
Name:5-cyclopropyl-1H-imidazol-2-amine
ZINC: ZINC000042684308
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).