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BioLiP Library

PDB CCD ID: D0M
Number of entries in BioLiP: 0
Chemical formula: C5 H13 N
InChI: InChI=1S/C5H13N/c1-3-5(6)4-2/h5H,3-4,6H2,1-2H3
InChIKey: PQPFFKCJENSZKL-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 1.7.0CCC(CC)N
ACDLabs 12.01NC(CC)CC
CACTVS 3.370CCC(N)CC
Name:pentan-3-amine
ChEMBL: CHEMBL14178
ZINC: ZINC000005023935
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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