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canSAR114856
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NAMES
    SMILES
    CC1CN(c2cc3c(cc2N)c(=O)c(C(=O)O)cn3C2CC2)CCN1
    InChI
    InChI=1S/C18H22N4O3/c1-10-8-21(5-4-20-10)16-7-15-12(6-14(16)19)17(23)13(18(24)25)9-22(15)11-2-3-11/h6-7,9-11,20H,2-5,8,19H2,1H3,(H,24,25)
    MOLECULAR FORMULA
    C18H22N4O3
    CROSS REFERENCES
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    canSAR114856

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 342.17
    AlogP 1.41
    HBond donors 4
    HBond acceptors 7
    Atoms 47
    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 canSAR114856.