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canSAR350278
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NAMES
    SMILES
    Cc1ncc(C(CC(=O)O)Cc2nc(CCCc3ccc4c(n3)NCCC4)no2)s1
    InChI
    InChI=1S/C21H25N5O3S/c1-13-23-12-17(30-13)15(11-20(27)28)10-19-25-18(26-29-19)6-2-5-16-8-7-14-4-3-9-22-21(14)24-16/h7-8,12,15H,2-6,9-11H2,1H3,(H,22,24)(H,27,28)
    MOLECULAR FORMULA
    C21H25N5O3S
    CROSS REFERENCES
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    canSAR350278

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 427.17
    AlogP 3.56
    HBond donors 2
    HBond acceptors 8
    Atoms 55
    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 canSAR350278.