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canSAR927118
FEATURES
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NAMES
    SMILES
    O=C(CCCCOCC12CC3CC(CC(C3)C1)C2)N[C@@H]1[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]12
    InChI
    InChI=1S/C23H37NO6/c25-11-16-20(27)21(28)18-19(22(18)30-16)24-17(26)3-1-2-4-29-12-23-8-13-5-14(9-23)7-15(6-13)10-23/h13-16,18-22,25,27-28H,1-12H2,(H,24,26)/t13?,14?,15?,16-,18?,19+,20-,21-,22+,23?/m1/s1
    MOLECULAR FORMULA
    C23H37NO6
    CROSS REFERENCES
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    canSAR927118

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 423.26
    AlogP 0.99
    HBond donors 4
    HBond acceptors 7
    Atoms 67
    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 canSAR927118.