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canSAR2049035
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NAMES
    SMILES
    O=C([O-])c1cn(C2CC2)c2cc(N3CCN(Cc4ccccc4)CC3)c(F)cc2c1=O.[K+]
    InChI
    InChI=1S/C24H24FN3O3.K/c25-20-12-18-21(28(17-6-7-17)15-19(23(18)29)24(30)31)13-22(20)27-10-8-26(9-11-27)14-16-4-2-1-3-5-16;/h1-5,12-13,15,17H,6-11,14H2,(H,30,31);/q;+1/p-1
    MOLECULAR FORMULA
    C24H23FKN3O3
    CROSS REFERENCES
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    canSAR2049035

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 459.14
    AlogP -0.83
    HBond donors 0
    HBond acceptors 6
    Atoms 55
    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 canSAR2049035.