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BioLiP

PDB CCD ID: 96B
Number of entries in BioLiP: 2
Chemical formula: C10 H13 N
InChI: InChI=1S/C10H13N/c1-2-5-9(6-3-1)10-7-4-8-11-10/h1-3,5-6,10-11H,4,7-8H2/t10-/m1/s1
InChIKey: JUTDHSGANMHVIC-SNVBAGLBSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 1.9.2c1ccc(cc1)[C@H]2CCCN2
CACTVS 3.385C1CN[C@H](C1)c2ccccc2
CACTVS 3.385C1CN[CH](C1)c2ccccc2
OpenEye OEToolkits 1.9.2c1ccc(cc1)C2CCCN2
ACDLabs 12.01N1C(CCC1)c2ccccc2
Name:(2R)-2-phenylpyrrolidine
ZINC: ZINC000001444851
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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