canSAR632474
FEATURES
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NAMES
    SMILES
    CCC(C)[C@@H](NCc1ccccc1)[C@H](OCc1ccccc1)[C@@H]1COC(C)(C)O1
    InChI
    InChI=1S/C25H35NO3/c1-5-19(2)23(26-16-20-12-8-6-9-13-20)24(22-18-28-25(3,4)29-22)27-17-21-14-10-7-11-15-21/h6-15,19,22-24,26H,5,16-18H2,1-4H3/t19?,22-,23+,24+/m0/s1
    MOLECULAR FORMULA
    C25H35NO3
    CROSS REFERENCES
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    canSAR632474
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight397.26
    AlogP4.93
    HBond donors1
    HBond acceptors4
    Atoms64
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR632474.