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canSAR1063672
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NAMES
    SMILES
    NC1=C(C(=O)c2ccccc2)C(c2ccc(Br)cc2)N(CCCn2ccnc2)C1=O
    InChI
    InChI=1S/C23H21BrN4O2/c24-18-9-7-16(8-10-18)21-19(22(29)17-5-2-1-3-6-17)20(25)23(30)28(21)13-4-12-27-14-11-26-15-27/h1-3,5-11,14-15,21H,4,12-13,25H2
    MOLECULAR FORMULA
    C23H21BrN4O2
    CROSS REFERENCES
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    canSAR1063672

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 464.08
    AlogP 3.71
    HBond donors 2
    HBond acceptors 6
    Atoms 51
    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 canSAR1063672.