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canSAR1144639
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NAMES
    SMILES
    Cc1onc(NC(=O)NC23CC4CC(CC(C4)C2)C3)c1Br
    InChI
    InChI=1S/C15H20BrN3O2/c1-8-12(16)13(19-21-8)17-14(20)18-15-5-9-2-10(6-15)4-11(3-9)7-15/h9-11H,2-7H2,1H3,(H2,17,18,19,20)
    MOLECULAR FORMULA
    C15H20BrN3O2
    CROSS REFERENCES
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    canSAR1144639

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 353.07
    AlogP 3.84
    HBond donors 2
    HBond acceptors 5
    Atoms 41
    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 canSAR1144639.