Structure

InChI Key QZZYPHBVOQMBAT-LRAGLOQXSA-N
Smile N[C@@H](Cc1ccc(OCC[18F])cc1)C(=O)O
InChI
InChI=1S/C11H14FNO3/c12-5-6-16-9-3-1-8(2-4-9)7-10(13)11(14)15/h1-4,10H,5-7,13H2,(H,14,15)/t10-/m0/s1/i12-1

Physicochemical Descriptors

Property Name Value
Molecular Formula C11H14FNO3
Molecular Weight 226.24
AlogP 0.99
Hydrogen Bond Acceptor 3.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 6.0
Polar Surface Area 72.55
Molecular species ZWITTERION
Aromatic Rings 1.0
Heavy Atoms 16.0

Cross References

Resources Reference
ChEMBL CHEMBL477278
DrugBank DB15405
FDA SRS 1326R5J1IA
SureChEMBL SCHEMBL11939889
ZINC ZINC000101627026