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canSAR838903
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NAMES
    SMILES
    CCOC(=O)C1=C(C)NC(=N)NC1c1cn(-c2ccccc2)nc1-c1ccc(Br)cc1
    InChI
    InChI=1S/C23H22BrN5O2/c1-3-31-22(30)19-14(2)26-23(25)27-21(19)18-13-29(17-7-5-4-6-8-17)28-20(18)15-9-11-16(24)12-10-15/h4-13,21H,3H2,1-2H3,(H3,25,26,27)
    MOLECULAR FORMULA
    C23H22BrN5O2
    CROSS REFERENCES
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    canSAR838903

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 479.10
    AlogP 4.31
    HBond donors 3
    HBond acceptors 7
    Atoms 53
    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 canSAR838903.