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BioLiP

PDB CCD ID: OD6
Number of entries in BioLiP: 1
Chemical formula: C16 H14 N2 Se
InChI: InChI=1S/C16H14N2Se/c17-16-18-15(11-19-16)14-8-6-13(7-9-14)10-12-4-2-1-3-5-12/h1-9,11H,10H2,(H2,17,18)
InChIKey: TVNNGQGXOFXDAF-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
CACTVS 3.385Nc1[se]cc(n1)c2ccc(Cc3ccccc3)cc2
OpenEye OEToolkits 3.1.0.0c1ccc(cc1)Cc2ccc(cc2)c3c[se]c(n3)N
Name:4-[4-(phenylmethyl)phenyl]-1,3-selenazol-2-amine;
4-(4-Benzylphenyl)-selenazol-2-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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