5611 logo
canSAR5611
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    Cc1ccc(Cn2c(N)nc3c(N(C)C)nc(C(F)(F)F)nc32)cc1
    InChI
    InChI=1S/C16H17F3N6/c1-9-4-6-10(7-5-9)8-25-13-11(21-15(25)20)12(24(2)3)22-14(23-13)16(17,18)19/h4-7H,8H2,1-3H3,(H2,20,21)
    MOLECULAR FORMULA
    C16H17F3N6
    CROSS REFERENCES
    5611 logo

    canSAR5611

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 350.15
    AlogP 2.85
    HBond donors 2
    HBond acceptors 6
    Atoms 42
    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 canSAR5611.