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canSAR1153819
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NAMES
    SMILES
    O=C1CCCC2=C1C(c1ccc(F)c(Br)c1)C1=C(CCCCS1(=O)=O)N2
    InChI
    InChI=1S/C19H19BrFNO3S/c20-12-10-11(7-8-13(12)21)17-18-14(5-3-6-16(18)23)22-15-4-1-2-9-26(24,25)19(15)17/h7-8,10,17,22H,1-6,9H2
    MOLECULAR FORMULA
    C19H19BrFNO3S
    CROSS REFERENCES
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    canSAR1153819

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 439.03
    AlogP 4.09
    HBond donors 1
    HBond acceptors 4
    Atoms 45
    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 canSAR1153819.