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canSAR2208654
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NAMES
    SMILES
    CN1CCC[C@@H](COc2nc(-c3ccc(C#N)cc3)c(-c3ccc4scnc4c3)n3cncc23)C1
    InChI
    InChI=1S/C27H24N6OS/c1-32-10-2-3-19(14-32)15-34-27-23-13-29-16-33(23)26(21-8-9-24-22(11-21)30-17-35-24)25(31-27)20-6-4-18(12-28)5-7-20/h4-9,11,13,16-17,19H,2-3,10,14-15H2,1H3/t19-/m1/s1
    MOLECULAR FORMULA
    C27H24N6OS
    CROSS REFERENCES
    2208654 logo

    canSAR2208654

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 480.17
    AlogP 5.27
    HBond donors 0
    HBond acceptors 7
    Atoms 59
    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 canSAR2208654.