Synonyms:
Status: Phase 2
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: 0VMV8Z3972

Structure

InChI Key FLZZFWBNYJNHMY-VNRZBHCFSA-N
Smile CCN(CC)C(=O)Cc1c(-c2ccc(OCC[18F])cc2)nn2c(C)cc(C)nc12
InChI
InChI=1S/C22H27FN4O2/c1-5-26(6-2)20(28)14-19-21(17-7-9-18(10-8-17)29-12-11-23)25-27-16(4)13-15(3)24-22(19)27/h7-10,13H,5-6,11-12,14H2,1-4H3/i23-1

Physicochemical Descriptors

Property Name Value
Molecular Formula C22H27FN4O2
Molecular Weight 397.48
AlogP 3.77
Hydrogen Bond Acceptor 5.0
Hydrogen Bond Donor 0.0
Number of Rotational Bond 8.0
Polar Surface Area 59.73
Molecular species NEUTRAL
Aromatic Rings 3.0
Heavy Atoms 29.0

Cross References

Resources Reference
ChEMBL CHEMBL451770
FDA SRS 0VMV8Z3972
SureChEMBL SCHEMBL12373846
ZINC ZINC000101510676