canSAR707771
FEATURES
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NAMES
    SMILES
    CCN(CC)c1ccc(Nc2nc(-c3c(C)nc4cc(C)ccn34)cs2)cc1
    InChI
    InChI=1S/C22H25N5S/c1-5-26(6-2)18-9-7-17(8-10-18)24-22-25-19(14-28-22)21-16(4)23-20-13-15(3)11-12-27(20)21/h7-14H,5-6H2,1-4H3,(H,24,25)
    MOLECULAR FORMULA
    C22H25N5S
    CROSS REFERENCES
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    canSAR707771
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight391.18
    AlogP5.66
    HBond donors1
    HBond acceptors5
    Atoms53
    Contains toxicophoreNo
    Contains PAINSYes
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR707771.