SEQ2FUN

BioLiP

PDB CCD ID: OUL
Number of entries in BioLiP: 2
Chemical formula: C14 H12 N2 O3
InChI: InChI=1S/C14H12N2O3/c15-13(17)9-1-5-11(6-2-9)19-12-7-3-10(4-8-12)14(16)18/h1-8H,(H2,15,17)(H2,16,18)
InChIKey: XZRCQWLPMXFGHE-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
CACTVS 3.385NC(=O)c1ccc(Oc2ccc(cc2)C(N)=O)cc1
OpenEye OEToolkits 2.0.6c1cc(ccc1C(=O)N)Oc2ccc(cc2)C(=O)N
Name:4-(4-aminocarbonylphenoxy)benzamide;
OUL35
ChEMBL: CHEMBL1438938
ZINC: ZINC000000235625
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).