canSAR2102637
FEATURES
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NAMES
    SMILES
    Cc1cccc2ccc(N3CC[C@H](C(=O)N[C@H]4CCC[C@H](CO)C4)C(C)(C)C3)nc12
    InChI
    InChI=1S/C25H35N3O2/c1-17-6-4-8-19-10-11-22(27-23(17)19)28-13-12-21(25(2,3)16-28)24(30)26-20-9-5-7-18(14-20)15-29/h4,6,8,10-11,18,20-21,29H,5,7,9,12-16H2,1-3H3,(H,26,30)/t18-,20-,21+/m0/s1
    MOLECULAR FORMULA
    C25H35N3O2
    CROSS REFERENCES
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    canSAR2102637
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight409.27
    AlogP4.06
    HBond donors2
    HBond acceptors5
    Atoms65
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2102637.