Structure

InChI Key AAFJXZWCNVJTMK-GUCUJZIJSA-N
Smile O[C@H]([C@@H]1CO1)[C@@H](O)[C@H]1CO1
InChI
InChI=1S/C6H10O4/c7-5(3-1-9-3)6(8)4-2-10-4/h3-8H,1-2H2/t3-,4+,5+,6-

Physicochemical Descriptors

Property Name Value
Molecular Formula C6H10O4
Molecular Weight 146.14
AlogP -1.49
Hydrogen Bond Acceptor 4.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 3.0
Polar Surface Area 65.52
Molecular species NEUTRAL
Aromatic Rings 0.0
Heavy Atoms 10.0

Pharmacology

Action Mechanism of Action Reference
CROSS-LINKING AGENT DNA cross-linking agent PubMed Other

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Glioblastoma 3 D005909 ClinicalTrials
Brain Neoplasms 3 D001932 ClinicalTrials
Ovarian Neoplasms 1 D010051 ClinicalTrials

Cross References

Resources Reference
ChEMBL CHEMBL3137322
DrugBank DB12873
EPA CompTox DTXSID90878831
FDA SRS 4S465RYF7M
SureChEMBL SCHEMBL4306431
ZINC ZINC000004963497