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canSAR1715861
FEATURES
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NAMES
    SMILES
    CCC(C)NC(=O)C1CCN(C(=O)c2ccc(-n3ccc4ccccc43)s2)CC1
    InChI
    InChI=1S/C23H27N3O2S/c1-3-16(2)24-22(27)18-10-13-25(14-11-18)23(28)20-8-9-21(29-20)26-15-12-17-6-4-5-7-19(17)26/h4-9,12,15-16,18H,3,10-11,13-14H2,1-2H3,(H,24,27)
    MOLECULAR FORMULA
    C23H27N3O2S
    CROSS REFERENCES
    1715861 logo

    canSAR1715861

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 409.18
    AlogP 4.46
    HBond donors 1
    HBond acceptors 5
    Atoms 56
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1715861.