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BioLiP

PDB CCD ID: A1BDM
Number of entries in BioLiP: 1
Chemical formula: C4 H3 Br N2
InChI: InChI=1S/C4H3BrN2/c5-4-6-2-1-3-7-4/h1-3H
InChIKey: PGFIHORVILKHIA-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 3.1.0.0c1cnc(nc1)Br
ACDLabs 14.52
CACTVS 3.385		Brc1ncccn1
Name:2-bromopyrimidine
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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