canSAR2096270
FEATURES
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NAMES
    SMILES
    O=C1CN(c2nc(N3CCC(CNC4CCC4)CC3)c3c(-c4ccccc4)csc3n2)CCN1
    InChI
    InChI=1S/C26H32N6OS/c33-22-16-32(14-11-27-22)26-29-24(31-12-9-18(10-13-31)15-28-20-7-4-8-20)23-21(17-34-25(23)30-26)19-5-2-1-3-6-19/h1-3,5-6,17-18,20,28H,4,7-16H2,(H,27,33)
    MOLECULAR FORMULA
    C26H32N6OS
    CROSS REFERENCES
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    canSAR2096270
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight476.24
    AlogP3.65
    HBond donors2
    HBond acceptors7
    Atoms66
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2096270.