exisulind Indications/Contra | FAERs-F | FAERs-M | Orange Bk | BioActivity |

Stem definitionDrug idCAS RN
3219 59973-80-7

Description:

MoleculeDescription

Molfile Inchi Smiles

Synonyms:

  • exisulind
  • aptosyn
  • sulindac sulfone
inhibits K-ras-dependent cyclooxygenase-2; sulfated analog of indomethacin;; CP248 is an antineoplastic agent that fosters microtubule depolymerization
  • Molecular weight: 372.41
  • Formula: C20H17FO4S
  • CLOGP: 3.11
  • LIPINSKI: 0
  • HAC: 4
  • HDO: 1
  • TPSA: 71.44
  • ALOGS: -5.38
  • ROTB: 4

Drug dosage:

None

ADMET properties:

None

Approvals:

None

FDA Adverse Event Reporting System (Female)

None

FDA Adverse Event Reporting System (Male)

None

Pharmacologic Action:

SourceCodeDescription
MeSH PA D000700 Analgesics
MeSH PA D018712 Analgesics, Non-Narcotic
MeSH PA D000893 Anti-Inflammatory Agents
MeSH PA D000894 Anti-Inflammatory Agents, Non-Steroidal
MeSH PA D016588 Anticarcinogenic Agents
MeSH PA D000970 Antineoplastic Agents
MeSH PA D018501 Antirheumatic Agents
MeSH PA D016861 Cyclooxygenase Inhibitors
MeSH PA D004791 Enzyme Inhibitors
MeSH PA D018373 Peripheral Nervous System Agents
MeSH PA D020011 Protective Agents
MeSH PA D018689 Sensory System Agents
CHEBI has role CHEBI:50629 cyclooxygenase-2 inhibitor
CHEBI has role CHEBI:64964 5-lipoxygenase inhibitor
CHEBI has role CHEBI:68495 type i programmed cell-death inducer

Drug Use (View source of the data)

None

Acid dissociation constants calculated using MoKa v3.0.0

Dissociation levelDissociation constantType (acidic/basic)
pKa1 4.33 acidic

Orange Book patent data (new drug applications)

None

Orange Book exclusivity data (new drug applications)

None

Bioactivity Summary:

TargetClassPharosUniProtActionTypeActivity value
(-log[M])
Mechanism
action
Bioact sourceMoA source
Endothelin-1 receptor GPCR Ki 5.22 DRUG MATRIX
Mitogen-activated protein kinase 1 Kinase IC50 4.86 DRUG MATRIX
Aldose reductase Enzyme IC50 6.57 DRUG MATRIX

External reference:

IDSource
C0935917 UMLSCUI
CHEBI:64212 CHEBI
SLO PDB_CHEM_ID
CHEMBL488025 ChEMBL_ID
DB06246 DRUGBANK_ID
5472495 PUBCHEM_CID
C025463 MESH_SUPPLEMENTAL_RECORD_UI
7744 INN_ID
K619IIG2R9 UNII

Pharmaceutical products:

None