1968541 logo
canSAR1968541
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CC(C)(O)COc1cc(-c2cnn(CCO)c2)c2c(c1)[C@@](O)(C(F)(F)F)c1ccccc1-2
    InChI
    InChI=1S/C23H23F3N2O4/c1-21(2,30)13-32-15-9-17(14-11-27-28(12-14)7-8-29)20-16-5-3-4-6-18(16)22(31,19(20)10-15)23(24,25)26/h3-6,9-12,29-31H,7-8,13H2,1-2H3/t22-/m1/s1
    MOLECULAR FORMULA
    C23H23F3N2O4
    CROSS REFERENCES
    1968541 logo

    canSAR1968541

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 448.16
    AlogP 3.47
    HBond donors 3
    HBond acceptors 6
    Atoms 55
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1968541.