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canSAR1092567
FEATURES
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NAMES
    SMILES
    c1cc(C2CCC3(CC2)OOC2(O3)C3CC4CC(C3)CC2C4)ccc1OCCN1CCOCC1
    InChI
    InChI=1S/C28H39NO5/c1-3-26(31-14-11-29-9-12-30-13-10-29)4-2-22(1)23-5-7-27(8-6-23)32-28(34-33-27)24-16-20-15-21(18-24)19-25(28)17-20/h1-4,20-21,23-25H,5-19H2
    MOLECULAR FORMULA
    C28H39NO5
    CROSS REFERENCES
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    canSAR1092567

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 469.28
    AlogP 4.88
    HBond donors 0
    HBond acceptors 6
    Atoms 73
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1092567.