Synonyms:
Status: Phase 3
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: WN1479YT50

Structure

InChI Key QFLNTQDOVCLQKW-UHFFFAOYSA-N
Smile CC(OC(=O)c1ccc(Cc2c(O)c3ccccc3oc2=O)cc1)(C(F)(F)F)C(F)(F)F
InChI
InChI=1S/C21H14F6O5/c1-19(20(22,23)24,21(25,26)27)32-17(29)12-8-6-11(7-9-12)10-14-16(28)13-4-2-3-5-15(13)31-18(14)30/h2-9,28H,10H2,1H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C21H14F6O5
Molecular Weight 460.33
AlogP 5.13
Hydrogen Bond Acceptor 5.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 4.0
Polar Surface Area 76.74
Molecular species ACID
Aromatic Rings 3.0
Heavy Atoms 32.0

Indications

Mesh Heading Maximum Phase Reference
Thromboembolism; Thrombosis Phase 3 ClinicalTrials

Related Entries

Scaffolds

Cross References

Resources Reference
CAS NUMBER 867257-26-9
ChEMBL CHEMBL2105664
DrugBank DB12823
EPA CompTox DTXSID90235788
FDA SRS WN1479YT50
PubChem 54718618
SureChEMBL SCHEMBL1647984