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canSAR208760
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NAMES
    SMILES
    CC(=O)NC(C)C#Cc1cnc(Oc2ccc(OCC3CC3)cc2Cl)s1
    InChI
    InChI=1S/C19H19ClN2O3S/c1-12(22-13(2)23)3-7-16-10-21-19(26-16)25-18-8-6-15(9-17(18)20)24-11-14-4-5-14/h6,8-10,12,14H,4-5,11H2,1-2H3,(H,22,23)
    MOLECULAR FORMULA
    C19H19ClN2O3S
    CROSS REFERENCES
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    canSAR208760

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 390.08
    AlogP 4.25
    HBond donors 1
    HBond acceptors 5
    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 canSAR208760.