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canSAR2083466
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NAMES
    SMILES
    CC1CN(c2cc(-c3cnc(N)c(OC(F)F)c3)nc(N3CCC3)n2)CCO1
    InChI
    InChI=1S/C18H22F2N6O2/c1-11-10-26(5-6-27-11)15-8-13(23-18(24-15)25-3-2-4-25)12-7-14(28-17(19)20)16(21)22-9-12/h7-9,11,17H,2-6,10H2,1H3,(H2,21,22)
    MOLECULAR FORMULA
    C18H22F2N6O2
    CROSS REFERENCES
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    canSAR2083466

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 392.18
    AlogP 2.16
    HBond donors 2
    HBond acceptors 8
    Atoms 50
    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 canSAR2083466.