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canSAR1768138
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NAMES
    SMILES
    Cc1c(C(=O)N2CCCCC2)c(S(=O)(=O)NCCc2ccccc2)c(C)n1C
    InChI
    InChI=1S/C21H29N3O3S/c1-16-19(21(25)24-14-8-5-9-15-24)20(17(2)23(16)3)28(26,27)22-13-12-18-10-6-4-7-11-18/h4,6-7,10-11,22H,5,8-9,12-15H2,1-3H3
    MOLECULAR FORMULA
    C21H29N3O3S
    CROSS REFERENCES
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    canSAR1768138

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 403.19
    AlogP 2.79
    HBond donors 1
    HBond acceptors 6
    Atoms 57
    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 canSAR1768138.