SEQ2FUN

BioLiP

PDB CCD ID: 8GF
Number of entries in BioLiP: 1
Chemical formula: C5 H7 N3
InChI: InChI=1S/C5H7N3/c1-4-7-3-2-5(6)8-4/h2-3H,1H3,(H2,6,7,8)
InChIKey: GKVDLTTVBNOGNJ-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
CACTVS 3.385Cc1nccc(N)n1
OpenEye OEToolkits 2.0.6Cc1nccc(n1)N
Name:2-methylpyrimidin-4-amine;
2-methyl-4-aminopyrimidine
ChEMBL: CHEMBL4579021
ZINC: ZINC000000333686
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).