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canSAR2085865
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NAMES
    SMILES
    C[C@H]1[C@H](NCc2cnc(C3CCCC3)[nH]2)C[C@@H]2C[C@H]1C2(C)C
    InChI
    InChI=1S/C19H31N3/c1-12-16-8-14(19(16,2)3)9-17(12)20-10-15-11-21-18(22-15)13-6-4-5-7-13/h11-14,16-17,20H,4-10H2,1-3H3,(H,21,22)/t12-,14+,16-,17-/m1/s1
    MOLECULAR FORMULA
    C19H31N3
    CROSS REFERENCES
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    canSAR2085865

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 301.25
    AlogP 4.23
    HBond donors 2
    HBond acceptors 3
    Atoms 53
    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 canSAR2085865.