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canSAR1765140
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NAMES
    SMILES
    Cc1nnc(SCC2=C(C(=O)O)N3C(=O)C(NC(=O)Cn4ncc(Cl)c4C)C3SC2)s1
    InChI
    InChI=1S/C17H17ClN6O4S3/c1-7-10(18)3-19-23(7)4-11(25)20-12-14(26)24-13(16(27)28)9(5-29-15(12)24)6-30-17-22-21-8(2)31-17/h3,12,15H,4-6H2,1-2H3,(H,20,25)(H,27,28)
    MOLECULAR FORMULA
    C17H17ClN6O4S3
    CROSS REFERENCES
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    canSAR1765140

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 500.02
    AlogP 1.54
    HBond donors 2
    HBond acceptors 10
    Atoms 48
    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 canSAR1765140.