DOXIFLURIDINE

Search structure
Synonyms:
Status: Approved
Entry Type: Small molecule
Molecule Category: Parent
UNII: V1JK16Y2JP

Structure
InChI Key ZWAOHEXOSAUJHY-ZIYNGMLESA-N
Smile C[C@H]1O[C@@H](n2cc(F)c(=O)[nH]c2=O)[C@H](O)[C@@H]1O
InChI
InChI=1S/C9H11FN2O5/c1-3-5(13)6(14)8(17-3)12-2-4(10)7(15)11-9(12)16/h2-3,5-6,8,13-14H,1H3,(H,11,15,16)/t3-,5-,6-,8-/m1/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C9H11FN2O5
Molecular Weight 246.19
AlogP -1.69
Hydrogen Bond Acceptor 6.0
Hydrogen Bond Donor 3.0
Number of Rotational Bond 1.0
Polar Surface Area 104.55
Molecular species NEUTRAL
Aromatic Rings 1.0
Heavy Atoms 17.0

Pharmacology

Action Mechanism of Action Reference
DISRUPTING AGENT DNA disrupting agent FDA PubMed

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Stomach Neoplasms 3 D013274 ClinicalTrials

Related Entries

MCS

Scaffolds

Cross References

Resources Reference
CAS NUMBER 3094-09-5
ChEBI 31521
ChEMBL CHEMBL1130
DrugBank DB12947
DrugCentral 958
EPA CompTox DTXSID2022967
FDA SRS V1JK16Y2JP
Human Metabolome Database HMDB0060406
KEGG C12739
PubChem 18343
SureChEMBL SCHEMBL8094
ZINC ZINC000001319177
CONTENTS