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canSAR2085638
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NAMES
    SMILES
    C=C(CO)[C@@H]1CC[C@@]2(C)OC3=C(C[C@@H]12)C(=O)[C@]1(O)CO[C@H]3C1
    InChI
    InChI=1S/C17H22O5/c1-9(7-18)10-3-4-16(2)12(10)5-11-14(22-16)13-6-17(20,8-21-13)15(11)19/h10,12-13,18,20H,1,3-8H2,2H3/t10-,12-,13-,16+,17+/m0/s1
    MOLECULAR FORMULA
    C17H22O5
    CROSS REFERENCES
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    canSAR2085638

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 306.15
    AlogP 1.10
    HBond donors 2
    HBond acceptors 5
    Atoms 44
    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 canSAR2085638.