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canSAR1988570
FEATURES
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NAMES
    SMILES
    O=C(CSc1nc2ccc(Nc3nc(N4CCOCC4)nc(N4CCOCC4)n3)cc2s1)NCc1ccco1
    InChI
    InChI=1S/C25H28N8O4S2/c34-21(26-15-18-2-1-9-37-18)16-38-25-28-19-4-3-17(14-20(19)39-25)27-22-29-23(32-5-10-35-11-6-32)31-24(30-22)33-7-12-36-13-8-33/h1-4,9,14H,5-8,10-13,15-16H2,(H,26,34)(H,27,29,30,31)
    MOLECULAR FORMULA
    C25H28N8O4S2
    CROSS REFERENCES
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    canSAR1988570

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 568.17
    AlogP 2.90
    HBond donors 2
    HBond acceptors 12
    Atoms 67
    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 canSAR1988570.