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canSAR1447626
FEATURES
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NAMES
    SMILES
    C/C(=C(/CCO)SS/C(CCO)=C(\C)N(C=O)Cc1cnc(C)nc1N)N(C=O)Cc1cnc(C)nc1N
    InChI
    InChI=1S/C24H34N8O4S2/c1-15(31(13-35)11-19-9-27-17(3)29-23(19)25)21(5-7-33)37-38-22(6-8-34)16(2)32(14-36)12-20-10-28-18(4)30-24(20)26/h9-10,13-14,33-34H,5-8,11-12H2,1-4H3,(H2,25,27,29)(H2,26,28,30)/b21-15+,22-16+
    MOLECULAR FORMULA
    C24H34N8O4S2
    CROSS REFERENCES
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    canSAR1447626

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 562.21
    AlogP 2.27
    HBond donors 6
    HBond acceptors 12
    Atoms 72
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1447626.