Ligand
Ligand Name:   N-Methylisatin
Ligand Type:   non-polymer
Ligand ID:   COVPDB342 PubChem:   16358
Synonym(s):  
  •   1-methylisatin
  • 2058-74-4
  • 1-methylindoline-2,3-dione
  • 1-methyl-1h-indole-2,3-dione
  • 1-methylindole-2,3-dione
  • 1h-indole-2,3-dione, 1-methyl-
  • 1-methyl-indole-2,3-dione
  • nsc 42449
  • 1 methylisatine
  • ol-57
  • mfcd00005812
  • 1-methyl-2,3-indolinedione
  • indole-2,3-dione, 1-methyl-
  • 1-methyl-2,3-dihydro-1h-indole-2,3-dione
  • n-methylindoline-2,3-dione
  • chembl60569
  • 1-methylisatin, 98%
  • 1-methylbenzo[d]azolidine-2,3-dione
  • 1-methyl-2,3-dihydroindole-2,3-dione
  • einecs 218-164-9
  • n-methylindol-2,3-dione
  • brn 0128280
  • n-methyl isatin
  • n-methyl isatine
  • isatin analog 8
  • 1-methylisatin, 97%
  • indole-2, 1-methyl-
  • acmc-1cs4t
  • 1h-indole-2, 1-methyl-
  • 5-21-10-00236 (beilstein handbook reference)
  • aronis24965
  • schembl126628
  • ind019
  • indole-2,3-dione, n-methyl-
  • bdbm10304
  • vcybvwftgazhgh-uhfffaoysa-
  • dtxsid80174591
  • ol 57
  • albb-016867
  • nsc42449
  • zinc1675288
  • 6972ad
  • bbl007926
  • fd7160
  • hts028119
  • nsc-42449
  • sbb006835
  • stk801660
  • akos000267191
  • fs-1270
  • mcule-1064235985
  • vz33377
  • ac-26339
  • ak-25575
  • sy048456
  • 1h-indole-2,3-dione, 1-methyl- (9ci)
  • ab0087890
  • db-032067
  • am20030312
  • cs-0045288
  • ft-0608044
  • m2706
  • st45028789
  • l-2736
  • a814728
  • j-013443
  • z56869450
  • f0722-0740
  • n‐methylindol‐2,3‐dione (compound 2)
show 68 synonym(s)
DrugBank:   - ChEMBL:   CHEMBL60569
Canonical SMILES:   CN1C(=O)C(=O)c(c12)cccc2
Standard InChI:   InChI=1S/C9H7NO2/c1-10-7-5-3-2-4-6(7)8(11)9(10)12/h2-5H,1H3
Molecular Formula:   C9H7NO2 Mol. Weight:   161.04768 logP:   0.8457
HBD:   0 HBA:   2
#Rotatable Bonds:   0 TPSA:   37.38

Bound Proteins
Protein Name Uniprot ID/ACC Organism PDB ID HET Code Binding Affinity Binding Database Complex Card
Parkinson disease protein 7 Q99497 (PARK7_HUMAN) Homo sapiens (Human) 6AFG 72V Kd : 13700 nM PDBBind SHOW