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canSAR1528726
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NAMES
    SMILES
    Cc1cc(C)nc(SCc2nnc(SCC(=O)N3CCCc4ccccc43)n2C)n1
    InChI
    InChI=1S/C21H24N6OS2/c1-14-11-15(2)23-20(22-14)29-12-18-24-25-21(26(18)3)30-13-19(28)27-10-6-8-16-7-4-5-9-17(16)27/h4-5,7,9,11H,6,8,10,12-13H2,1-3H3
    MOLECULAR FORMULA
    C21H24N6OS2
    CROSS REFERENCES
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    canSAR1528726

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 440.15
    AlogP 3.59
    HBond donors 0
    HBond acceptors 7
    Atoms 54
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1528726.