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canSAR2000582
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NAMES
    SMILES
    Cc1cc(C)c2c(-n3cccc3)c(C(=O)NCCCN3CCCCC3)sc2n1
    InChI
    InChI=1S/C22H28N4OS/c1-16-15-17(2)24-22-18(16)19(26-13-6-7-14-26)20(28-22)21(27)23-9-8-12-25-10-4-3-5-11-25/h6-7,13-15H,3-5,8-12H2,1-2H3,(H,23,27)
    MOLECULAR FORMULA
    C22H28N4OS
    CROSS REFERENCES
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    canSAR2000582

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 396.20
    AlogP 4.31
    HBond donors 1
    HBond acceptors 5
    Atoms 56
    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 canSAR2000582.