SEQ2FUN

BioLiP

PDB CCD ID: BVF
Number of entries in BioLiP: 4
Chemical formula: C6 H8 N2
InChI: InChI=1S/C6H8N2/c1-5-2-3-8-6(7)4-5/h2-4H,1H3,(H2,7,8)
InChIKey: ORLGLBZRQYOWNA-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
ACDLabs 10.04n1ccc(cc1N)C
OpenEye OEToolkits 1.5.0Cc1ccnc(c1)N
CACTVS 3.341Cc1ccnc(N)c1
Name:4-METHYLPYRIDIN-2-AMINE;
2-AMINO-4-PICOLINE
ChEMBL: CHEMBL40833
ZINC: ZINC000000149580
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).