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canSAR1266950
FEATURES
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NAMES
    SMILES
    CC(=O)Nc1nc(C2CCN(C(=O)c3cccnc3)CC2)cs1
    InChI
    InChI=1S/C16H18N4O2S/c1-11(21)18-16-19-14(10-23-16)12-4-7-20(8-5-12)15(22)13-3-2-6-17-9-13/h2-3,6,9-10,12H,4-5,7-8H2,1H3,(H,18,19,21)
    MOLECULAR FORMULA
    C16H18N4O2S
    CROSS REFERENCES
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    canSAR1266950

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 330.12
    AlogP 2.52
    HBond donors 1
    HBond acceptors 6
    Atoms 41
    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 canSAR1266950.