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

Stem definitionDrug idCAS RN
754 516-21-2

Description:

MoleculeDescription

Molfile Inchi Smiles

Synonyms:

  • cycloguanil
  • cycloguanil embonate
  • cycloguanil pamoate
the active metabolite of proguanil; antifolate drug
  • Molecular weight: 251.72
  • Formula: C11H14ClN5
  • CLOGP: 1.07
  • LIPINSKI: 0
  • HAC: 5
  • HDO: 2
  • TPSA: 80
  • ALOGS: -3.01
  • ROTB: 1

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
ATC P01BB02 ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
ANTIPROTOZOALS
ANTIMALARIALS
Biguanides
MeSH PA D000890 Anti-Infective Agents
MeSH PA D000962 Antimalarials
MeSH PA D000977 Antiparasitic Agents
MeSH PA D000981 Antiprotozoal Agents
MeSH PA D004791 Enzyme Inhibitors
MeSH PA D005493 Folic Acid Antagonists

Drug Use (View source of the data)

None

Acid dissociation constants calculated using MoKa v3.0.0

Dissociation levelDissociation constantType (acidic/basic)
pKa1 11.2 Basic
pKa2 4.66 Basic
pKa3 3.37 Basic

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
Dihydrofolate reductase Enzyme Ki 7.25 CHEMBL
Bifunctional dihydrofolate reductase-thymidylate synthase Enzyme INHIBITOR Ki 8.96 CHEMBL CHEMBL
Dihydrofolate reductase Enzyme Ki 7.63 CHEMBL
Dihydrofolate reductase Enzyme Ki 4.76 CHEMBL
Dihydrofolate reductase Enzyme Ki 6.95 CHEMBL
Dihydrofolate reductase Enzyme IC50 6.96 CHEMBL

External reference:

IDSource
D02387 KEGG_DRUG
26RM326WVN UNII
002945 NDDF
CHEBI:4003 CHEBI
CHEMBL747 ChEMBL_ID
CHEMBL588912 ChEMBL_ID
1527 INN_ID
609-78-9 SECONDARY_CAS_RN
1CY PDB_CHEM_ID
10027 IUPHAR_LIGAND_ID
9049 PUBCHEM_CID
DB14763 DRUGBANK_ID
CHEMBL3989825 ChEMBL_ID
C026009 MESH_SUPPLEMENTAL_RECORD_UI
C073266 MESH_SUPPLEMENTAL_RECORD_UI

Pharmaceutical products:

None