canSAR2079814
FEATURES
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NAMES
    SMILES
    C#CCNc1cc(-c2cc(N[C@@H]3CCCc4ccccc43)nc(C)n2)ccc1C
    InChI
    InChI=1S/C25H26N4/c1-4-14-26-23-15-20(13-12-17(23)2)24-16-25(28-18(3)27-24)29-22-11-7-9-19-8-5-6-10-21(19)22/h1,5-6,8,10,12-13,15-16,22,26H,7,9,11,14H2,2-3H3,(H,27,28,29)/t22-/m1/s1
    MOLECULAR FORMULA
    C25H26N4
    CROSS REFERENCES
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    canSAR2079814
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight382.22
    AlogP5.30
    HBond donors2
    HBond acceptors4
    Atoms55
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2079814.