canSAR108991
FEATURES
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NAMES
    SMILES
    O=C(NCCCn1ccnc1)c1ccc(Br)o1
    InChI
    InChI=1S/C11H12BrN3O2/c12-10-3-2-9(17-10)11(16)14-4-1-6-15-7-5-13-8-15/h2-3,5,7-8H,1,4,6H2,(H,14,16)
    MOLECULAR FORMULA
    C11H12BrN3O2
    CROSS REFERENCES
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    canSAR108991
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight297.01
    AlogP2.06
    HBond donors1
    HBond acceptors5
    Atoms29
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR108991.