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canSAR842291
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NAMES
    SMILES
    C=C1CCC[C@]2(C)C[C@H]3OC(=O)[C@@H](CNCc4ccccc4)[C@H]3C[C@@H]12
    InChI
    InChI=1S/C22H29NO2/c1-15-7-6-10-22(2)12-20-17(11-19(15)22)18(21(24)25-20)14-23-13-16-8-4-3-5-9-16/h3-5,8-9,17-20,23H,1,6-7,10-14H2,2H3/t17-,18+,19+,20-,22-/m1/s1
    MOLECULAR FORMULA
    C22H29NO2
    CROSS REFERENCES
    842291 logo

    canSAR842291

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 339.22
    AlogP 4.09
    HBond donors 1
    HBond acceptors 3
    Atoms 54
    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 canSAR842291.