Ligand
Ligand Name:   isatoic anhydride
Ligand Type:   non-polymer
Ligand ID:   COVPDB1321 PubChem:   8359
Synonym(s):  
  •   118-48-9
  • 1h-benzo[d][1,3]oxazine-2,4-dione
  • 2h-3,1-benzoxazine-2,4(1h)-dione
  • 4h-3,1-benzoxazine-2,4(1h)-dione
  • isatoic acid anhydride
  • 1h-3,1-benzoxazine-2,4-dione
  • isato acid anhydride
  • n-carboxyanthranilic anhydride
  • unii-r8tfa74y4u
  • 3,1-benzoxazine-2,4(1h)-dione
  • anthranilic acid, n-carboxy-, cyclic anhydride
  • mfcd00006700
  • benzoic acid, 2-(carboxyamino)-, cyclic anhydride
  • r8tfa74y4u
  • chembl346059
  • isatoic anhydride, 98%
  • dsstox_cid_6955
  • 2,4-dihydro-1h-3,1-benzoxazine-2,4-dione
  • 2h-3,4(1h)-dione
  • dsstox_rid_78267
  • dsstox_gsid_26955
  • anthranilic acid, cyclic anhydride
  • benzo[d]1,3-oxazine-2,4-dione
  • cas-118-48-9
  • hsdb 5017
  • einecs 204-255-0
  • nsc 104662
  • brn 0136786
  • ai3-24983
  • 1h-3,1-benzoxazine-2,4-quinone
  • pubchem13599
  • acmc-1bvlv
  • anthranilic acid n-carboxylic acid anhydride
  • isatoic anhydride, 96%
  • ec 204-255-0
  • nciopen2_002029
  • schembl16251
  • isatoic acid,anhydride
  • 4-27-00-03330 (beilstein handbook reference)
  • isatoic anhydride treated bsa
  • dtxsid6026955
  • 2,4-dioxo-1h-3,1-benzoxazine
  • hms1607f14
  • 1h-[3,1]benzoxazine-2,4-dione
  • cs-m0780
  • nsc29555
  • zinc8739076
  • tox21_201325
  • tox21_303058
  • 3,1-benzoxazin-2,4-(1h)-dione
  • anw-17139
  • bbl009904
  • bdbm50201570
  • nsc-29555
  • nsc104662
  • sbb003928
  • stk711078
  • 1h-benzo[d][1,3]oxazine-2,4dione
  • 2h-3,1-benzoxazine-2,4(1h)dione
  • 1h-benz(d)(1,3)oxazine-2,4-dione
  • akos000120179
  • 1h-benzo[d][1,3]oxazin-2,4-dione
  • ac-3291
  • db11593
  • fs-3311
  • mcule-9285695361
  • nsc-104662
  • 2h-3,1-benzoxazine-2,4-(1h)-dione
  • ncgc00164009-01
  • ncgc00164009-02
  • ncgc00257195-01
  • ncgc00258877-01
  • ak-54762
  • bp-10896
  • u260
  • 1,2-dihydro-3,1-benzoxazine-2,4-dione
  • db-041408
  • ft-0627312
  • i0081
  • st50330601
  • 2,4-dioxo-1,2-dihydro-4h-3,1-benzoxazine
  • az0001-0075
  • isatoic anhydride treated bovine serum albumin
  • isatoic anhydride, technical, >=94% (hplc)
  • m-7243
  • 118i489
  • a803947
  • ae-641/30105041
  • q-103228
  • q11286492
  • f0036-0953
  • z1245636373
show 91 synonym(s)
DrugBank:   DB11593 ChEMBL:   CHEMBL346059
Canonical SMILES:   O=c1oc(=O)[nH]c(c12)cccc2
Standard InChI:   InChI=1S/C8H5NO3/c10-7-5-3-1-2-4-6(5)9-8(11)12-7/h1-4H,(H,9,11)
Molecular Formula:   C8H5NO3 Mol. Weight:   163.02695 logP:   0.4813
HBD:   1 HBA:   3
#Rotatable Bonds:   0 TPSA:   63.07

Bound Proteins
Protein Name Uniprot ID/ACC Organism PDB ID HET Code Binding Affinity Binding Database Complex Card
Complement factor D P00746 (CFAD_HUMAN) Homo sapiens (Human) 1BIO SOA IC50 : 2900 nM PDBBind SHOW