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canSAR1121158
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NAMES
    SMILES
    Cc1cccc(C)c1CCC(=O)Nc1nnc2n1CCS2
    InChI
    InChI=1S/C15H18N4OS/c1-10-4-3-5-11(2)12(10)6-7-13(20)16-14-17-18-15-19(14)8-9-21-15/h3-5H,6-9H2,1-2H3,(H,16,17,20)
    MOLECULAR FORMULA
    C15H18N4OS
    CROSS REFERENCES
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    canSAR1121158

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 302.12
    AlogP 2.57
    HBond donors 1
    HBond acceptors 5
    Atoms 39
    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 canSAR1121158.