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canSAR197621
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NAMES
    SMILES
    O=C(NCCCc1cccc2c1C[C@@H](CCCCc1ccccc1)O2)C1CC1
    InChI
    InChI=1S/C25H31NO2/c27-25(21-15-16-21)26-17-7-12-20-11-6-14-24-23(20)18-22(28-24)13-5-4-10-19-8-2-1-3-9-19/h1-3,6,8-9,11,14,21-22H,4-5,7,10,12-13,15-18H2,(H,26,27)/t22-/m1/s1
    MOLECULAR FORMULA
    C25H31NO2
    CROSS REFERENCES
    197621 logo

    canSAR197621

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 377.24
    AlogP 4.86
    HBond donors 1
    HBond acceptors 3
    Atoms 59
    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 canSAR197621.