irofulven 🐶 Veterinary Use | Indications/Contra | FAERs-F | FAERs-M | Orange Bk | BioActivity |

Stem definitionDrug idCAS RN
antineoplastics, acylfulvene derivatives 1483 158440-71-2

Description:

MoleculeDescription

Molfile Inchi Smiles

Synonyms:

  • 6-hydroxymethylacylfulvene
  • MGI-114
  • irofulven
  • (-)-Irofulven
  • Molecular weight: 246.31
  • Formula: C15H18O3
  • CLOGP: 0.59
  • LIPINSKI: 0
  • HAC: 3
  • HDO: 2
  • TPSA: 57.53
  • ALOGS: -2.68
  • ROTB: 1

Drug dosage:

None

ADMET properties:

PropertyValueReference
Vd (Volume of distribution) 3.10 L/kg Lombardo F, Berellini G, Obach RS
CL (Clearance) 140 mL/min/kg Lombardo F, Berellini G, Obach RS
t_half (Half-life) 0.30 hours Lombardo F, Berellini G, Obach RS
BDDCS (Biopharmaceutical Drug Disposition Classification System) 2 Bocci G, Oprea TI, Benet LZ

Approvals:

None

FDA Adverse Event Reporting System (Female)

None

FDA Adverse Event Reporting System (Male)

None

FDA Adverse Event Reporting System (Geriatric)

None

FDA Adverse Event Reporting System (Pediatric)

None

Pharmacologic Action:

SourceCodeDescription
MeSH PA D000477 Alkylating Agents
MeSH PA D000970 Antineoplastic Agents
MeSH PA D018906 Antineoplastic Agents, Alkylating
MeSH PA D009676 Noxae
MeSH PA D011838 Radiation-Sensitizing Agents

Drug Use | Suggest Off label Use Form| |View source of the data|

None




🐶 Veterinary Drug Use

None

🐶 Veterinary products

None

Acid dissociation constants calculated using MoKa v3.0.0

Dissociation levelDissociation constantType (acidic/basic)
pKa1 12.82 acidic
pKa2 13.67 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
Serine/threonine-protein kinase Chk2 Kinase WOMBAT-PK

External reference:

IDSource
D04614 KEGG_DRUG
C0532362 UMLSCUI
CHEBI:135002 CHEBI
CHEMBL118218 ChEMBL_ID
DB05786 DRUGBANK_ID
C102714 MESH_SUPPLEMENTAL_RECORD_UI
148189 PUBCHEM_CID
7889 INN_ID
6B799IH05A UNII

Pharmaceutical products:

None