SEQ2FUN

BioLiP

PDB CCD ID: BSU
Number of entries in BioLiP: 10
Chemical formula: C13 H12 N2 O
InChI: InChI=1S/C13H12N2O/c16-13(14-11-7-3-1-4-8-11)15-12-9-5-2-6-10-12/h1-10H,(H2,14,15,16)
InChIKey: GWEHVDNNLFDJLR-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 1.5.0c1ccc(cc1)NC(=O)Nc2ccccc2
ACDLabs 10.04
CACTVS 3.341		O=C(Nc1ccccc1)Nc2ccccc2
Name:1,3-DIPHENYLUREA;
DIPHENYLCARBAMIDE
ChEMBL: CHEMBL354676
DrugBank: DB07496
ZINC: ZINC000012416741
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).