SEQ2FUN

BioLiP

PDB CCD ID: 8C7
Number of entries in BioLiP: 1
Chemical formula: C14 H19 N O2
InChI: InChI=1S/C14H19NO2/c15-14(16)12-6-8-13(9-7-12)17-10-11-4-2-1-3-5-11/h6-9,11H,1-5,10H2,(H2,15,16)
InChIKey: MJTCIHDRDLBAGL-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 2.0.7c1cc(ccc1C(=O)N)OCC2CCCCC2
CACTVS 3.385NC(=O)c1ccc(OCC2CCCCC2)cc1
Name:4-(cyclohexylmethoxy)benzamide
ChEMBL: CHEMBL5178227
ZINC: ZINC000007509984
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).