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canSAR843212
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NAMES
    SMILES
    NC(=O)c1cc(N2C[C@H]3CNC[C@H]32)cnc1Br
    InChI
    InChI=1S/C11H13BrN4O/c12-10-8(11(13)17)1-7(3-15-10)16-5-6-2-14-4-9(6)16/h1,3,6,9,14H,2,4-5H2,(H2,13,17)/t6-,9-/m1/s1
    MOLECULAR FORMULA
    C11H13BrN4O
    CROSS REFERENCES
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    canSAR843212

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 296.03
    AlogP 0.35
    HBond donors 3
    HBond acceptors 5
    Atoms 30
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR843212.