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canSAR1123538
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NAMES
    SMILES
    COc1ccc2c(c1)C(=O)N(c1nc(C(=O)Nc3cnc(C)cc3N3CCNCC3)cs1)C2
    InChI
    InChI=1S/C23H24N6O3S/c1-14-9-20(28-7-5-24-6-8-28)18(11-25-14)26-21(30)19-13-33-23(27-19)29-12-15-3-4-16(32-2)10-17(15)22(29)31/h3-4,9-11,13,24H,5-8,12H2,1-2H3,(H,26,30)
    MOLECULAR FORMULA
    C23H24N6O3S
    CROSS REFERENCES
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    canSAR1123538

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 464.16
    AlogP 2.68
    HBond donors 2
    HBond acceptors 9
    Atoms 57
    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 canSAR1123538.