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canSAR1516991
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NAMES
    SMILES
    COc1cc2ccccc2cc1C(=O)N(CCN(C)C)c1nc2ccc(Br)cc2s1
    InChI
    InChI=1S/C23H22BrN3O2S/c1-26(2)10-11-27(23-25-19-9-8-17(24)14-21(19)30-23)22(28)18-12-15-6-4-5-7-16(15)13-20(18)29-3/h4-9,12-14H,10-11H2,1-3H3
    MOLECULAR FORMULA
    C23H22BrN3O2S
    CROSS REFERENCES
    1516991 logo

    canSAR1516991

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 483.06
    AlogP 5.43
    HBond donors 0
    HBond acceptors 5
    Atoms 52
    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 canSAR1516991.