CEDAZURIDINE

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Synonyms
Status
Molecule Category Free-form
UNII 39IS23Q1EW

Structure

InChI Key VUDZSIYXZUYWSC-DBRKOABJSA-N
Smiles O=C1N[C@H](O)CCN1[C@@H]1O[C@H](CO)[C@@H](O)C1(F)F
InChI
InChI=1S/C9H14F2N2O5/c10-9(11)6(16)4(3-14)18-7(9)13-2-1-5(15)12-8(13)17/h4-7,14-16H,1-3H2,(H,12,17)/t4-,5-,6-,7-/m1/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C9H14F2N2O5
Molecular Weight 268.22
AlogP -1.57
Hydrogen Bond Acceptor 5.0
Hydrogen Bond Donor 4.0
Number of Rotational Bond 2.0
Polar Surface Area 102.26
Molecular species NEUTRAL
Aromatic Rings 0.0
Heavy Atoms 18.0

Pharmacology

Mechanism of Action Action Reference
Cytidine deaminase inhibitor INHIBITOR FDA
Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Enzyme Hydrolase
- 400 - - -
EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Homo sapiens
- 400 - - -

Target Conservation

Protein: Cytidine deaminase
Description: Cytidine deaminase
Organism : Homo sapiens
P32320 ENSG00000158825

Cross References

Resources Reference
ChEMBL CHEMBL3237547
DrugBank DB15694
FDA SRS 39IS23Q1EW
Guide to Pharmacology 11101
PubChem 25267009
SureChEMBL SCHEMBL172256
ZINC ZINC000043205136
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