SEQ2FUN

BioLiP

PDB CCD ID: 8NF
Number of entries in BioLiP: 2
Chemical formula: C7 H10 N2
InChI: InChI=1S/C7H10N2/c1-5-3-6(2)9-4-7(5)8/h3-4H,8H2,1-2H3
InChIKey: SHSQTJRJQHPJRQ-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
CACTVS 3.385Cc1cc(C)c(N)cn1
OpenEye OEToolkits 2.0.7Cc1cc(ncc1N)C
Name:5-amino-2,4-dimethylpyridine
ChEMBL: CHEMBL4860378
ZINC: ZINC000003881104
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).