2047942 logo
canSAR2047942
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    Cc1ccc(N2CCc3ncnc(NCc4ccccc4C(F)(F)F)c3C2)nc1
    InChI
    InChI=1S/C21H20F3N5/c1-14-6-7-19(25-10-14)29-9-8-18-16(12-29)20(28-13-27-18)26-11-15-4-2-3-5-17(15)21(22,23)24/h2-7,10,13H,8-9,11-12H2,1H3,(H,26,27,28)
    MOLECULAR FORMULA
    C21H20F3N5
    CROSS REFERENCES
    2047942 logo

    canSAR2047942

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 399.17
    AlogP 4.37
    HBond donors 1
    HBond acceptors 5
    Atoms 49
    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 canSAR2047942.