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canSAR1862241
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NAMES
    SMILES
    Fc1cccc2nc(N[C@H]3C[C@@H](Oc4nccnc4C4CCOCC4)C3)sc12
    InChI
    InChI=1S/C20H21FN4O2S/c21-15-2-1-3-16-18(15)28-20(25-16)24-13-10-14(11-13)27-19-17(22-6-7-23-19)12-4-8-26-9-5-12/h1-3,6-7,12-14H,4-5,8-11H2,(H,24,25)/t13-,14+
    MOLECULAR FORMULA
    C20H21FN4O2S
    CROSS REFERENCES
    1862241 logo

    canSAR1862241

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 400.14
    AlogP 4.14
    HBond donors 1
    HBond acceptors 6
    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 canSAR1862241.