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canSAR1506547
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NAMES
    SMILES
    CC(=O)Nc1cc(C(=O)NCCN2CCN(Cc3ccccc3)CC2)ccc1Sc1ccc(C)cc1
    InChI
    InChI=1S/C29H34N4O2S/c1-22-8-11-26(12-9-22)36-28-13-10-25(20-27(28)31-23(2)34)29(35)30-14-15-32-16-18-33(19-17-32)21-24-6-4-3-5-7-24/h3-13,20H,14-19,21H2,1-2H3,(H,30,35)(H,31,34)
    MOLECULAR FORMULA
    C29H34N4O2S
    CROSS REFERENCES
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    canSAR1506547

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 502.24
    AlogP 4.65
    HBond donors 2
    HBond acceptors 6
    Atoms 70
    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 canSAR1506547.