Ligand
Ligand Name:   5-[(E)-3-(furan-2-yl)prop-2-enylidene]-1,3-diazinane-2,4,6-trione
Ligand Type:   non-polymer
Ligand ID:   COVPDB274 PubChem:   690389
Synonym(s):  
  •   schembl14712884
  • zinc8994583
  • stk170423
  • akos000325801
  • mcule-5172990300
  • sr-03000003092
  • sr-03000003092-1
  • 5-[(2e)-3-(2-furyl)prop-2-enylidene]pyrimidine-2,4,6(1h,3h,5h)-trione
  • 5-[(2e)-3-(furan-2-yl)prop-2-en-1-ylidene]pyrimidine-2,4,6(1h,3h,5h)-trione
  • 343879-19-6
show 9 synonym(s)
DrugBank:   - ChEMBL:   -
Canonical SMILES:   O=C1NC(=O)C(=C\C=C\c2ccco2)C(=O)N1
Standard InChI:   InChI=1S/C11H8N2O4/c14-9-8(10(15)13-11(16)12-9)5-1-3-7-4-2-6-17-7/h1-6H,(H2,12,13,14,15,16)/b3-1+
Molecular Formula:   C11H8N2O4 Mol. Weight:   232.0484 logP:   0.5852
HBD:   2 HBA:   4
#Rotatable Bonds:   2 TPSA:   88.41

Bound Proteins
Protein Name Uniprot ID/ACC Organism PDB ID HET Code Binding Affinity Binding Database Complex Card
Dihydroorotate dehydrogenase (fumarate) Q4D3W2 (PYRD_TRYCC) Trypanosoma cruzi (strain CL Brener) 5E93 5LL
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