672968 logo
canSAR672968
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    O=C(NCc1ccc(C(F)(F)F)cc1Oc1ccccc1)Nc1cccc2[nH]ncc12
    InChI
    InChI=1S/C22H17F3N4O2/c23-22(24,25)15-10-9-14(20(11-15)31-16-5-2-1-3-6-16)12-26-21(30)28-18-7-4-8-19-17(18)13-27-29-19/h1-11,13H,12H2,(H,27,29)(H2,26,28,30)
    MOLECULAR FORMULA
    C22H17F3N4O2
    CROSS REFERENCES
    672968 logo

    canSAR672968

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 426.13
    AlogP 5.70
    HBond donors 3
    HBond acceptors 6
    Atoms 48
    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 canSAR672968.