canSAR824201
FEATURES
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NAMES
    SMILES
    CC(C)c1ccc(NC(=O)Oc2ccc3c(c2)[C@]2(C)CCN(CCCc4ccccc4)[C@@H]2N3C)cc1
    InChI
    InChI=1S/C31H37N3O2/c1-22(2)24-12-14-25(15-13-24)32-30(35)36-26-16-17-28-27(21-26)31(3)18-20-34(29(31)33(28)4)19-8-11-23-9-6-5-7-10-23/h5-7,9-10,12-17,21-22,29H,8,11,18-20H2,1-4H3,(H,32,35)/t29-,31-/m0/s1
    MOLECULAR FORMULA
    C31H37N3O2
    CROSS REFERENCES
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    canSAR824201
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight483.29
    AlogP6.79
    HBond donors1
    HBond acceptors5
    Atoms73
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR824201.