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canSAR1638433
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NAMES
    SMILES
    Cc1ccc(Nc2nc(C(=O)N3CCC(C(=O)NCCN4CCOCC4)CC3)cs2)cc1
    InChI
    InChI=1S/C23H31N5O3S/c1-17-2-4-19(5-3-17)25-23-26-20(16-32-23)22(30)28-9-6-18(7-10-28)21(29)24-8-11-27-12-14-31-15-13-27/h2-5,16,18H,6-15H2,1H3,(H,24,29)(H,25,26)
    MOLECULAR FORMULA
    C23H31N5O3S
    CROSS REFERENCES
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    canSAR1638433

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 457.21
    AlogP 2.50
    HBond donors 2
    HBond acceptors 8
    Atoms 63
    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 canSAR1638433.