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BioLiP

PDB CCD ID: XBB
Number of entries in BioLiP: 0
Chemical formula: C5 H10 N2
InChI: InChI=1S/C5H10N2/c6-5-2-1-3-7-4-5/h3,5H,1-2,4,6H2/t5-/m1/s1
InChIKey: SEECZTVWJNGUEJ-RXMQYKEDSA-N
SMILES:
SoftwareSMILES
ACDLabs 10.04N1=CCCC(N)C1
OpenEye OEToolkits 1.5.0C1C[C@H](CN=C1)N
OpenEye OEToolkits 1.5.0C1CC(CN=C1)N
CACTVS 3.341N[CH]1CCC=NC1
CACTVS 3.341N[C@@H]1CCC=NC1
Name:(3S)-2,3,4,5-TETRAHYDROPYRIDIN-3-AMINE
DrugBank: DB04504
ZINC: ZINC000022039222
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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