FORODESINE HYDROCHLORIDE

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Synonyms
Status
Molecule Category Salt-form
UNII 6SN82Y9U73
EPA CompTox DTXSID90182647

Structure

InChI Key WEIAMZKHBCLFOG-QPAIBFMUSA-N
Smiles Cl.O=c1[nH]cnc2c([C@@H]3N[C@H](CO)[C@@H](O)[C@H]3O)c[nH]c12
InChI
InChI=1S/C11H14N4O4.ClH/c16-2-5-9(17)10(18)7(15-5)4-1-12-8-6(4)13-3-14-11(8)19;/h1,3,5,7,9-10,12,15-18H,2H2,(H,13,14,19);1H/t5-,7+,9-,10+;/m1./s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C11H15ClN4O4
Molecular Weight 302.72
AlogP -2.02
Hydrogen Bond Acceptor 6.0
Hydrogen Bond Donor 6.0
Number of Rotational Bond 2.0
Polar Surface Area 134.26
Molecular species NEUTRAL
Aromatic Rings 2.0
Heavy Atoms 19.0

Pharmacology

Mechanism of Action Action Reference
Purine nucleoside phosphorylase inhibitor INHIBITOR PubMed

Target Conservation

Protein: Purine nucleoside phosphorylase
Description: Purine nucleoside phosphorylase
Organism : Homo sapiens
P00491 ENSG00000198805

Cross References

Resources Reference
ChEMBL CHEMBL550755
FDA SRS 6SN82Y9U73
SureChEMBL SCHEMBL1949526
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