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canSAR1020655
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NAMES
    SMILES
    COc1ccc2c(c1)CCNC2c1ccc(S(N)(=O)=O)cc1
    InChI
    InChI=1S/C16H18N2O3S/c1-21-13-4-7-15-12(10-13)8-9-18-16(15)11-2-5-14(6-3-11)22(17,19)20/h2-7,10,16,18H,8-9H2,1H3,(H2,17,19,20)
    MOLECULAR FORMULA
    C16H18N2O3S
    CROSS REFERENCES
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    canSAR1020655

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 318.10
    AlogP 1.58
    HBond donors 3
    HBond acceptors 5
    Atoms 40
    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 canSAR1020655.