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canSAR1722938
FEATURES
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NAMES
    SMILES
    CC(C)(C)[C@@]1(O)CCN2C[C@@H]3c4ccccc4CCc4cccc(c43)[C@@H]2C1
    InChI
    InChI=1S/C25H31NO/c1-24(2,3)25(27)13-14-26-16-21-19-9-5-4-7-17(19)11-12-18-8-6-10-20(23(18)21)22(26)15-25/h4-10,21-22,27H,11-16H2,1-3H3/t21-,22+,25-/m1/s1
    MOLECULAR FORMULA
    C25H31NO
    CROSS REFERENCES
    1722938 logo

    canSAR1722938

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 361.24
    AlogP 4.84
    HBond donors 1
    HBond acceptors 2
    Atoms 58
    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 canSAR1722938.