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canSAR2084505
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NAMES
    SMILES
    OC1CCN(CC2CCN(c3ncnc4scc(C5CCCCC5)c34)CC2)C1
    InChI
    InChI=1S/C22H32N4OS/c27-18-8-9-25(13-18)12-16-6-10-26(11-7-16)21-20-19(17-4-2-1-3-5-17)14-28-22(20)24-15-23-21/h14-18,27H,1-13H2
    MOLECULAR FORMULA
    C22H32N4OS
    CROSS REFERENCES
    2084505 logo

    canSAR2084505

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 400.23
    AlogP 4.02
    HBond donors 1
    HBond acceptors 5
    Atoms 60
    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 canSAR2084505.