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canSAR672159
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NAMES
    SMILES
    Cc1nc(Nc2ccc(CCNc3ncnc4ccsc34)cc2)[nH]c1C
    InChI
    InChI=1S/C19H20N6S/c1-12-13(2)24-19(23-12)25-15-5-3-14(4-6-15)7-9-20-18-17-16(8-10-26-17)21-11-22-18/h3-6,8,10-11H,7,9H2,1-2H3,(H,20,21,22)(H2,23,24,25)
    MOLECULAR FORMULA
    C19H20N6S
    CROSS REFERENCES
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    canSAR672159

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 364.15
    AlogP 4.43
    HBond donors 3
    HBond acceptors 6
    Atoms 46
    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 canSAR672159.