aminoquinuride indications/contra

Stem definitionDrug idCAS RN
quinoline derivatives 174 3811-56-1

Description:

MoleculeDescription

Molfile Inchi Smiles

Synonyms:

  • aminoquinuride
  • aminochinuride
  • aminokinuride
  • aminoquincarbamide
  • surfen
  • Molecular weight: 372.43
  • Formula: C21H20N6O
  • CLOGP: 4.11
  • LIPINSKI: 0
  • HAC: 7
  • HDO: 4
  • TPSA: 118.95
  • ALOGS: -4.53
  • ROTB: 2

Drug dosage:

None

Approvals:

None

FDA Adverse Event Reporting System

None

Pharmacologic Action:

None

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 11.93 acidic
pKa2 12.51 acidic
pKa3 8.85 Basic
pKa4 8.25 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
Matrix metalloproteinase-9 Enzyme IC50 4 CHEMBL
Interstitial collagenase Enzyme IC50 4.51 CHEMBL
Botulinum neurotoxin type A Enzyme IC50 5.14 CHEMBL
Lethal factor Enzyme Ki 6.30 CHEMBL

External reference:

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IDSource
C0051675 UMLSCUI
08T7936572 UNII
63 INN_ID
17747 RXNORM
006338 NDDF
CHEMBL87223 ChEMBL_ID
71166 PUBCHEM_CID
C010850 MESH_SUPPLEMENTAL_RECORD_UI
DB04452 DRUGBANK_ID
NSC PDB_CHEM_ID

Pharmaceutical products:

None