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BioLiP

PDB CCD ID: 71L
Number of entries in BioLiP: 1
Chemical formula: C7 H10 N2
InChI: InChI=1S/C7H10N2/c1-5-3-6(2)9-7(8)4-5/h3-4H,1-2H3,(H2,8,9)
InChIKey: BRBUBVKGJRPRRD-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 2.0.5Cc1cc(nc(c1)N)C
ACDLabs 12.01c1(N)cc(cc(n1)C)C
CACTVS 3.385Cc1cc(C)nc(N)c1
Name:4,6-dimethylpyridin-2-amine
ChEMBL: CHEMBL59925
ZINC: ZINC000019118456
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)(download the PDF file).
  • 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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