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canSAR1635544
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NAMES
    SMILES
    CC1CCN(c2c(NCC3CCC(C(=O)NCCC4=CCCCC4)CC3)c(=O)c2=O)CC1
    InChI
    InChI=1S/C26H39N3O3/c1-18-12-15-29(16-13-18)23-22(24(30)25(23)31)28-17-20-7-9-21(10-8-20)26(32)27-14-11-19-5-3-2-4-6-19/h5,18,20-21,28H,2-4,6-17H2,1H3,(H,27,32)
    MOLECULAR FORMULA
    C26H39N3O3
    CROSS REFERENCES
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    canSAR1635544

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 441.30
    AlogP 3.74
    HBond donors 2
    HBond acceptors 6
    Atoms 71
    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 canSAR1635544.