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canSAR1999919
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NAMES
    SMILES
    CN1CCCN(c2nc(NC3CCN(Cc4ccccc4)CC3)c3sccc3n2)CC1
    InChI
    InChI=1S/C24H32N6S/c1-28-11-5-12-30(16-15-28)24-26-21-10-17-31-22(21)23(27-24)25-20-8-13-29(14-9-20)18-19-6-3-2-4-7-19/h2-4,6-7,10,17,20H,5,8-9,11-16,18H2,1H3,(H,25,26,27)
    MOLECULAR FORMULA
    C24H32N6S
    CROSS REFERENCES
    1999919 logo

    canSAR1999919

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 436.24
    AlogP 3.91
    HBond donors 1
    HBond acceptors 6
    Atoms 63
    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 canSAR1999919.