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canSAR991508
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NAMES
    SMILES
    O=C1c2cc3c(cc2OCN1CCn1cc(Br)cn1)C(=O)N1CCCC1O3
    InChI
    InChI=1S/C18H17BrN4O4/c19-11-8-20-22(9-11)5-4-21-10-26-14-6-13-15(7-12(14)17(21)24)27-16-2-1-3-23(16)18(13)25/h6-9,16H,1-5,10H2
    MOLECULAR FORMULA
    C18H17BrN4O4
    CROSS REFERENCES
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    canSAR991508

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 432.04
    AlogP 2.09
    HBond donors 0
    HBond acceptors 8
    Atoms 44
    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 canSAR991508.