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canSAR1432708
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NAMES
    SMILES
    O=C(N[C@H]1CC(F)(F)C[C@@H]1Nc1ccc(OC(F)F)cn1)c1ccccc1-n1nccn1
    InChI
    InChI=1S/C20H18F4N6O2/c21-19(22)32-12-5-6-17(25-11-12)28-14-9-20(23,24)10-15(14)29-18(31)13-3-1-2-4-16(13)30-26-7-8-27-30/h1-8,11,14-15,19H,9-10H2,(H,25,28)(H,29,31)/t14-,15-/m0/s1
    MOLECULAR FORMULA
    C20H18F4N6O2
    CROSS REFERENCES
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    canSAR1432708

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 450.14
    AlogP 3.27
    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 canSAR1432708.