CLEVUDINE

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Synonyms
Status
Molecule Category Free-form
ATC J05AF12
UNII IN51MVP5F1

Structure

InChI Key GBBJCSTXCAQSSJ-XQXXSGGOSA-N
Smiles Cc1cn([C@H]2O[C@@H](CO)[C@H](O)[C@H]2F)c(=O)[nH]c1=O
InChI
InChI=1S/C10H13FN2O5/c1-4-2-13(10(17)12-8(4)16)9-6(11)7(15)5(3-14)18-9/h2,5-7,9,14-15H,3H2,1H3,(H,12,16,17)/t5-,6+,7-,9-/m0/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C10H13FN2O5
Molecular Weight 260.22
AlogP -1.57
Hydrogen Bond Acceptor 6.0
Hydrogen Bond Donor 3.0
Number of Rotational Bond 2.0
Polar Surface Area 104.55
Molecular species NEUTRAL
Aromatic Rings 1.0
Heavy Atoms 18.0

Pharmacology

Mechanism of Action Action Reference
Protein P inhibitor INHIBITOR PubMed PubMed
EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Hepatitis B virus
100 - - - -

Related Entries

Cross References

Resources Reference
ChEBI 135964
ChEMBL CHEMBL458875
DrugBank DB06683
DrugCentral 4394
FDA SRS IN51MVP5F1
PubChem 73115
SureChEMBL SCHEMBL233494
ZINC ZINC000000001484
CONTENTS