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canSAR1861123
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NAMES
    SMILES
    CC(C)(O)C1CCC(C(=O)N2CC[C@@]3(C)c4ccccc4C[C@@H]2C3(C)C)CC1
    InChI
    InChI=1S/C25H37NO2/c1-23(2)21-16-18-8-6-7-9-20(18)25(23,5)14-15-26(21)22(27)17-10-12-19(13-11-17)24(3,4)28/h6-9,17,19,21,28H,10-16H2,1-5H3/t17?,19-,21-,25+/m1/s1
    MOLECULAR FORMULA
    C25H37NO2
    CROSS REFERENCES
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    canSAR1861123

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 383.28
    AlogP 4.70
    HBond donors 1
    HBond acceptors 3
    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 canSAR1861123.