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canSAR1969173
FEATURES
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NAMES
    SMILES
    Cl.O=C(NCC(c1cccs1)N1CCOCC1)c1ccc(Br)o1
    InChI
    InChI=1S/C15H17BrN2O3S.ClH/c16-14-4-3-12(21-14)15(19)17-10-11(13-2-1-9-22-13)18-5-7-20-8-6-18;/h1-4,9,11H,5-8,10H2,(H,17,19);1H
    MOLECULAR FORMULA
    C15H18BrClN2O3S
    CROSS REFERENCES
    1969173 logo

    canSAR1969173

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 419.99
    AlogP 3.33
    HBond donors 1
    HBond acceptors 5
    Atoms 41
    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 canSAR1969173.