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BioLiP

PDB CCD ID: W3J
Number of entries in BioLiP: 6
Chemical formula: C4 H9 N3
InChI: InChI=1S/C4H9N3/c5-4-6-2-1-3-7-4/h1-3H2,(H3,5,6,7)
InChIKey: PEHDFSFYZKSKGH-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
CACTVS 3.385NC1=NCCCN1
OpenEye OEToolkits 2.0.7C1CNC(=NC1)N
ACDLabs 12.01N1C(N)=NCCC1
Name:1,4,5,6-tetrahydropyrimidin-2-amine
ChEMBL: CHEMBL158626
ZINC: ZINC000001728936
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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