Structure

InChI Key GEBHVOHKNWLITQ-DEVVULMSSA-N
Smile N[C@H](Cc1ccc(OC[18F])cc1)C(=O)O
InChI
InChI=1S/C10H12FNO3/c11-6-15-8-3-1-7(2-4-8)5-9(12)10(13)14/h1-4,9H,5-6,12H2,(H,13,14)/t9-/m1/s1/i11-1

Physicochemical Descriptors

Property Name Value
Molecular Formula C10H12FNO3
Molecular Weight 212.21
AlogP 0.95
Hydrogen Bond Acceptor 3.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 5.0
Polar Surface Area 72.55
Molecular species ZWITTERION
Aromatic Rings 1.0
Heavy Atoms 15.0

Cross References

Resources Reference
ChEMBL CHEMBL4297357
DrugBank DB15296
FDA SRS 58HVN5SR99
PubChem 11579379
SureChEMBL SCHEMBL15944856