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canSAR112730
FEATURES
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NAMES
    SMILES
    CCc1cnc(-c2ccccc2CCc2cc(Br)ccc2OC)n1C
    InChI
    InChI=1S/C21H23BrN2O/c1-4-18-14-23-21(24(18)2)19-8-6-5-7-15(19)9-10-16-13-17(22)11-12-20(16)25-3/h5-8,11-14H,4,9-10H2,1-3H3
    MOLECULAR FORMULA
    C21H23BrN2O
    CROSS REFERENCES
    112730 logo

    canSAR112730

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 398.10
    AlogP 5.21
    HBond donors 0
    HBond acceptors 3
    Atoms 48
    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 canSAR112730.