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canSAR1099101
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NAMES
    SMILES
    COc1cc(N2CCN(C(=O)Cn3nc(C(F)(F)F)c(Cl)c3C)CC2)cc(Br)c1Cl
    InChI
    InChI=1S/C18H18BrCl2F3N4O2/c1-10-15(20)17(18(22,23)24)25-28(10)9-14(29)27-5-3-26(4-6-27)11-7-12(19)16(21)13(8-11)30-2/h7-8H,3-6,9H2,1-2H3
    MOLECULAR FORMULA
    C18H18BrCl2F3N4O2
    CROSS REFERENCES
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    canSAR1099101

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 527.99
    AlogP 4.64
    HBond donors 0
    HBond acceptors 6
    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 canSAR1099101.