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canSAR112660
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NAMES
    SMILES
    CCOC(=O)Nc1cc(N[C@@H](C)[C@H](O)c2ccccc2)c(N)c(N)n1
    InChI
    InChI=1S/C17H23N5O3/c1-3-25-17(24)22-13-9-12(14(18)16(19)21-13)20-10(2)15(23)11-7-5-4-6-8-11/h4-10,15,23H,3,18H2,1-2H3,(H4,19,20,21,22,24)/t10-,15-/m0/s1
    MOLECULAR FORMULA
    C17H23N5O3
    CROSS REFERENCES
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    canSAR112660

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 345.18
    AlogP 2.35
    HBond donors 7
    HBond acceptors 8
    Atoms 48
    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 canSAR112660.