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canSAR1649684
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NAMES
    SMILES
    CCCc1cc2c(cc1NC(=O)c1ccc(Br)cc1)OCO2
    InChI
    InChI=1S/C17H16BrNO3/c1-2-3-12-8-15-16(22-10-21-15)9-14(12)19-17(20)11-4-6-13(18)7-5-11/h4-9H,2-3,10H2,1H3,(H,19,20)
    MOLECULAR FORMULA
    C17H16BrNO3
    CROSS REFERENCES
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    canSAR1649684

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 361.03
    AlogP 4.38
    HBond donors 1
    HBond acceptors 4
    Atoms 38
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1649684.