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canSAR2091234
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NAMES
    SMILES
    CC1=C(C(=O)OC(C)C)C(c2ccco2)n2ccnc2N1
    InChI
    InChI=1S/C15H17N3O3/c1-9(2)21-14(19)12-10(3)17-15-16-6-7-18(15)13(12)11-5-4-8-20-11/h4-9,13H,1-3H3,(H,16,17)
    MOLECULAR FORMULA
    C15H17N3O3
    CROSS REFERENCES
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    canSAR2091234

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 287.13
    AlogP 2.72
    HBond donors 1
    HBond acceptors 6
    Atoms 38
    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 canSAR2091234.