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canSAR653430
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NAMES
    SMILES
    CNC(=O)Nc1ccc(-c2nc(N3CC4CCC(C3)O4)c3sc(CN4CCN(C)CC4)cc3n2)cc1
    InChI
    InChI=1S/C26H33N7O2S/c1-27-26(34)28-18-5-3-17(4-6-18)24-29-22-13-21(16-32-11-9-31(2)10-12-32)36-23(22)25(30-24)33-14-19-7-8-20(15-33)35-19/h3-6,13,19-20H,7-12,14-16H2,1-2H3,(H2,27,28,34)
    MOLECULAR FORMULA
    C26H33N7O2S
    CROSS REFERENCES
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    canSAR653430

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 507.24
    AlogP 3.22
    HBond donors 2
    HBond acceptors 9
    Atoms 69
    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 canSAR653430.