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BioLiP

PDB CCD ID: YZM
Number of entries in BioLiP: 1
Chemical formula: C8 H8 N2 O2
InChI: InChI=1S/C8H8N2O2/c9-8(12)10-7(11)6-4-2-1-3-5-6/h1-5H,(H3,9,10,11,12)
InChIKey: HRYILSDLIGTCOP-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 1.7.6c1ccc(cc1)C(=O)NC(=O)N
CACTVS 3.370NC(=O)NC(=O)c1ccccc1
ACDLabs 12.01O=C(NC(=O)N)c1ccccc1
Name:N-carbamoylbenzamide
ZINC: ZINC000000156273
Reference:
  • Chengxin Zhang, Xi Zhang, Peter L 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).

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