SEQ2FUN

BioLiP

PDB CCD ID: LVD
Number of entries in BioLiP: 4
Chemical formula: C8 H10 N2 O2
InChI: InChI=1S/C8H10N2O2/c9-8(11)10-12-6-7-4-2-1-3-5-7/h1-5H,6H2,(H3,9,10,11)
InChIKey: IXRIVZOKBPYSPK-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 2.0.6c1ccc(cc1)CONC(=O)N
CACTVS 3.385NC(=O)NOCc1ccccc1
Name:1-phenylmethoxyurea
ChEMBL: CHEMBL1867851
ZINC: ZINC000000084002
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).