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BioLiP

PDB CCD ID: NVI
Number of entries in BioLiP: 5
Chemical formula: C5 H7 N2
InChI: InChI=1S/C5H6N2/c1-2-7-4-3-6-5-7/h2-5H,1H2/p+1
InChIKey: OSSNTDFYBPYIEC-UHFFFAOYSA-O
SMILES:
SoftwareSMILES
OpenEye OEToolkits 1.5.0C=C[n+]1cc[nH]c1
ACDLabs 10.04C=C\[n+]1ccnc1
CACTVS 3.341C=C[n+]1c[nH]cc1
Name:1-VINYLIMIDAZOLE
ZINC: ZINC000005853223
Reference:
  • Chengxin Zhang, Xi Zhang, Peter L 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).

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