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BioLiP

PDB CCD ID: XGY
Number of entries in BioLiP: 1
Chemical formula: C4 H11 N3
InChI: InChI=1S/C4H11N3/c1-7-2-4(5)6-3-7/h4,6H,2-3,5H2,1H3/t4-/m0/s1
InChIKey: VFALPSXHULBHMC-BYPYZUCNSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 2.0.7CN1C[C@H](NC1)N
ACDLabs 12.01
OpenEye OEToolkits 2.0.7		CN1CC(NC1)N
CACTVS 3.385CN1CN[C@H](N)C1
CACTVS 3.385CN1CN[CH](N)C1
Name:(4S)-1-methylimidazolidin-4-amine
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).
  • 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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