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canSAR1157052
FEATURES
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NAMES
    SMILES
    CCCNC(=S)NS(=O)(=O)c1ccc(N2N=C(c3ccc(OC)cc3)CCC2=O)cc1
    InChI
    InChI=1S/C21H24N4O4S2/c1-3-14-22-21(30)24-31(27,28)18-10-6-16(7-11-18)25-20(26)13-12-19(23-25)15-4-8-17(29-2)9-5-15/h4-11H,3,12-14H2,1-2H3,(H2,22,24,30)
    MOLECULAR FORMULA
    C21H24N4O4S2
    CROSS REFERENCES
    1157052 logo

    canSAR1157052

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 460.12
    AlogP 2.79
    HBond donors 2
    HBond acceptors 8
    Atoms 55
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1157052.