SEQ2FUN

BioLiP

PDB CCD ID: LJJ
Number of entries in BioLiP: 1
Chemical formula: C10 H17 N3 O
InChI: InChI=1S/C10H17N3O/c1-8-12-13-10(14-8)11-9-6-4-2-3-5-7-9/h9H,2-7H2,1H3,(H,11,13)
InChIKey: BHDKFMDJCREHTJ-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 2.0.6Cc1nnc(o1)NC2CCCCCC2
CACTVS 3.385Cc1oc(NC2CCCCCC2)nn1
ACDLabs 12.01n2nc(NC1CCCCCC1)oc2C
Name:N-cycloheptyl-5-methyl-1,3,4-oxadiazol-2-amine
Reference:
  • Chengxin Zhang, Xi Zhang, Lydia 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).