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canSAR1065241
FEATURES
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NAMES
    SMILES
    CCCC[C@@](C)(O)C1CC23C=C[C@]1(C)[C@@H]1Oc4c(O)ccc5c4C12CCN(C)C3C5
    InChI
    InChI=1S/C26H35NO3/c1-5-6-9-24(3,29)18-15-25-11-10-23(18,2)22-26(25)12-13-27(4)19(25)14-16-7-8-17(28)21(30-22)20(16)26/h7-8,10-11,18-19,22,28-29H,5-6,9,12-15H2,1-4H3/t18?,19?,22-,23-,24+,25?,26?/m0/s1
    MOLECULAR FORMULA
    C26H35NO3
    CROSS REFERENCES
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    canSAR1065241

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 409.26
    AlogP 4.17
    HBond donors 2
    HBond acceptors 4
    Atoms 65
    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 canSAR1065241.