Synonyms:
Status: Approved (1994)
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: H0QPM375HE

Structure

InChI Key ZCXUVYAZINUVJD-QZABAPFNSA-N
Smile OC[C@H]1O[C@@H](O)[C@H](F)[C@@H](O)[C@@H]1O
InChI
InChI=1S/C6H11FO5/c7-3-5(10)4(9)2(1-8)12-6(3)11/h2-6,8-11H,1H2/t2-,3-,4-,5-,6-/m1/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C6H11FO5
Molecular Weight 182.15
AlogP -2.24
Hydrogen Bond Acceptor 5.0
Hydrogen Bond Donor 4.0
Number of Rotational Bond 1.0
Polar Surface Area 90.15
Molecular species NEUTRAL
Aromatic Rings 0.0
Heavy Atoms 12.0

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Carcinoma, Non-Small-Cell Lung 2 D002289 ClinicalTrials
Colorectal Neoplasms 2 D015179 ClinicalTrials

Cross References

Resources Reference
ChEBI 49132
ChEMBL CHEMBL1086863
DrugBank DB04282
FDA SRS H0QPM375HE
PDB G2F
PubChem 170049
SureChEMBL SCHEMBL5674906
ZINC ZINC000003809846