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canSAR789497
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NAMES
    SMILES
    CCCN1CCO[C@@H]2Cc3nc(N)sc3C[C@H]21
    InChI
    InChI=1S/C12H19N3OS/c1-2-3-15-4-5-16-10-6-8-11(7-9(10)15)17-12(13)14-8/h9-10H,2-7H2,1H3,(H2,13,14)/t9-,10-/m1/s1
    MOLECULAR FORMULA
    C12H19N3OS
    CROSS REFERENCES
    789497 logo

    canSAR789497

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 253.12
    AlogP 1.30
    HBond donors 2
    HBond acceptors 4
    Atoms 36
    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 canSAR789497.