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canSAR1595131
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NAMES
    SMILES
    CC(C)=CCCC(C)CN1CCC(n2nccc2NC(=O)c2ccc3c(c2)OCO3)CC1
    InChI
    InChI=1S/C25H34N4O3/c1-18(2)5-4-6-19(3)16-28-13-10-21(11-14-28)29-24(9-12-26-29)27-25(30)20-7-8-22-23(15-20)32-17-31-22/h5,7-9,12,15,19,21H,4,6,10-11,13-14,16-17H2,1-3H3,(H,27,30)
    MOLECULAR FORMULA
    C25H34N4O3
    CROSS REFERENCES
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    canSAR1595131

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 438.26
    AlogP 4.88
    HBond donors 1
    HBond acceptors 7
    Atoms 66
    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 canSAR1595131.