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canSAR1088424
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NAMES
    SMILES
    CC(C)CCC[C@@H](C)[C@H]1CC[C@@]2(C)C(=O)[C@@H](N3C(C)COCC3C)CC[C@]12C
    InChI
    InChI=1S/C25H45NO2/c1-17(2)9-8-10-18(3)21-11-13-25(7)23(27)22(12-14-24(21,25)6)26-19(4)15-28-16-20(26)5/h17-22H,8-16H2,1-7H3/t18-,19?,20?,21-,22+,24-,25+/m1/s1
    MOLECULAR FORMULA
    C25H45NO2
    CROSS REFERENCES
    1088424 logo

    canSAR1088424

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 391.35
    AlogP 5.71
    HBond donors 0
    HBond acceptors 3
    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 canSAR1088424.