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canSAR78375
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NAMES
    SMILES
    COc1cccc(OC)c1OCCNC[C@H]1Oc2ccccc2O[C@H]1c1ccc(O)cc1
    InChI
    InChI=1S/C25H27NO6/c1-28-21-8-5-9-22(29-2)25(21)30-15-14-26-16-23-24(17-10-12-18(27)13-11-17)32-20-7-4-3-6-19(20)31-23/h3-13,23-24,26-27H,14-16H2,1-2H3/t23-,24+/m1/s1
    MOLECULAR FORMULA
    C25H27NO6
    CROSS REFERENCES
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    canSAR78375

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 437.18
    AlogP 3.96
    HBond donors 2
    HBond acceptors 7
    Atoms 59
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR78375.