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canSAR787314
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NAMES
    SMILES
    CCN1C[C@H]2C[C@@]2(c2ccc(NS(=O)(=O)c3ccc(C(C)C)cc3)cc2)C1
    InChI
    InChI=1S/C22H28N2O2S/c1-4-24-14-19-13-22(19,15-24)18-7-9-20(10-8-18)23-27(25,26)21-11-5-17(6-12-21)16(2)3/h5-12,16,19,23H,4,13-15H2,1-3H3/t19-,22+/m1/s1
    MOLECULAR FORMULA
    C22H28N2O2S
    CROSS REFERENCES
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    canSAR787314

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 384.19
    AlogP 4.20
    HBond donors 1
    HBond acceptors 4
    Atoms 55
    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 canSAR787314.