bisantrene indications/contra

Stem definitionDrug idCAS RN
376 78186-34-2

Description:

MoleculeDescription

Molfile Inchi Smiles

Synonyms:

  • bisantrene dihydrochloride
  • bisantrene hydrochloride
  • bisantrene
  • Molecular weight: 398.47
  • Formula: C22H22N8
  • CLOGP: 2.11
  • LIPINSKI: 0
  • HAC: 8
  • HDO: 4
  • TPSA: 97.56
  • ALOGS: -4.18
  • ROTB: 4

Drug dosage:

None

Approvals:

None

FDA Adverse Event Reporting System

None

Pharmacologic Action:

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SourceCodeDescription
MeSH PA D000903 Antibiotics, Antineoplastic
MeSH PA D000970 Antineoplastic Agents
CHEBI has role CHEBI:35610 antineoplastic agent

Drug Use (View source of the data)

None

Acid dissociation constants calculated using MoKa v3.0.0

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Dissociation levelDissociation constantType (acidic/basic)
pKa1 9.53 Basic
pKa2 8.92 Basic
pKa3 5.15 Basic
pKa4 4.55 Basic

Orange Book patent data (new drug applications)

None

Orange Book exclusivity data (new drug applications)

None

Bioactivity Summary:

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TargetClassPharosUniProtActionTypeActivity value
(-log[M])
Mechanism
action
Bioact sourceMoA source
NAD(P)H dehydrogenase [quinone] 1 Enzyme IC50 4.60 CHEMBL

External reference:

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IDSource
CHEMBL25336 ChEMBL_ID
39C34M111K UNII
5131 INN_ID
71439-68-4 SECONDARY_CAS_RN
CHEMBL139554 ChEMBL_ID
5351322 PUBCHEM_CID
CHEMBL1979684 ChEMBL_ID
C031404 MESH_SUPPLEMENTAL_RECORD_UI
CHEBI:88337 CHEBI

Pharmaceutical products:

None