EFLORNITHINE HYDROCHLORIDE

Search structure
Synonyms:
Status: Approved (1990)
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: 4NH22NDW9H

Structure
InChI Key FJPAMFNRCFEGSD-UHFFFAOYSA-N
Smile Cl.NCCCC(N)(C(=O)O)C(F)F.O
InChI
InChI=1S/C6H12F2N2O2.ClH.H2O/c7-4(8)6(10,5(11)12)2-1-3-9;;/h4H,1-3,9-10H2,(H,11,12);1H;1H2

Physicochemical Descriptors

Property Name Value
Molecular Formula C6H15ClF2N2O3
Molecular Weight 236.65
AlogP -0.23
Hydrogen Bond Acceptor 3.0
Hydrogen Bond Donor 3.0
Number of Rotational Bond 5.0
Polar Surface Area 89.34
Molecular species ZWITTERION
Aromatic Rings 0.0
Heavy Atoms 12.0

Pharmacology

Action Mechanism of Action Reference
INHIBITOR Ornithine decarboxylase inhibitor
Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Enzyme Protease Cysteine protease Cysteine protease CA clan Cysteine protease C1A family
- - - - 30.7
Enzyme Transferase
- - - - 11.61-16.65
Epigenetic regulator Eraser Histone deacetylase HDAC class IIb
- - - - -23.09--20.98

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Adenomatous Polyposis Coli 3 D011125 ClinicalTrials
Neuroblastoma 2 D009447 ClinicalTrials

Cross References

Resources Reference
ChEBI 4762
ChEMBL CHEMBL1201037
FDA SRS 4NH22NDW9H
PubChem 441361
SureChEMBL SCHEMBL4510
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