canSAR2097175
FEATURES
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NAMES
    SMILES
    C[C@H]1[C@H](NCc2[nH]cnc2C(C)(C)C)C[C@@H]2C[C@H]1C2(C)C
    InChI
    InChI=1S/C18H31N3/c1-11-13-7-12(18(13,5)6)8-14(11)19-9-15-16(17(2,3)4)21-10-20-15/h10-14,19H,7-9H2,1-6H3,(H,20,21)/t11-,12+,13-,14-/m1/s1
    MOLECULAR FORMULA
    C18H31N3
    CROSS REFERENCES
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    canSAR2097175
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight289.25
    AlogP3.87
    HBond donors2
    HBond acceptors3
    Atoms52
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2097175.