Ligand
Ligand Name:   4-OXOSEBACIC ACID
Ligand Type:   non-polymer
Ligand ID:   COVPDB239 PubChem:   1755
Synonym(s):  
  •   4-oxodecanedioic acid
  • decanedioic acid, 4-oxo-
  • 3-oxo-1,8-octanedicarboxylic acid
  • 114212-45-2
  • schembl1053787
  • zinc3074811
  • akos024339724
  • db02260
  • mcule-8689766454
  • q27093294
show 9 synonym(s)
DrugBank:   DB02260 ChEMBL:   CHEMBL1230315
Canonical SMILES:   OC(=O)CCCCCC(=O)CCC(O)=O
Standard InChI:   InChI=1S/C10H16O5/c11-8(6-7-10(14)15)4-2-1-3-5-9(12)13/h1-7H2,(H,12,13)(H,14,15)
Molecular Formula:   C10H16O5 Mol. Weight:   216.09978 logP:   1.4554
HBD:   2 HBA:   3
#Rotatable Bonds:   9 TPSA:   91.67

Bound Proteins
Protein Name Uniprot ID/ACC Organism PDB ID HET Code Binding Affinity Binding Database Complex Card
Delta-aminolevulinic acid dehydratase P05373 (HEM2_YEAST) Saccharomyces cerevisiae (strain ATCC 204508 / S288c) (Baker's yeast) 1GJP 4OX
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