canSAR54285
FEATURES
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NAMES
    SMILES
    C[C@H]1C2Cc3ccc(SC(=O)c4ccccc4)cc3[C@]1(C)CCN2CCc1cccs1
    InChI
    InChI=1S/C27H29NOS2/c1-19-25-17-21-10-11-23(31-26(29)20-7-4-3-5-8-20)18-24(21)27(19,2)13-15-28(25)14-12-22-9-6-16-30-22/h3-11,16,18-19,25H,12-15,17H2,1-2H3/t19-,25?,27+/m0/s1
    MOLECULAR FORMULA
    C27H29NOS2
    CROSS REFERENCES
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    canSAR54285
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight447.17
    AlogP6.45
    HBond donors0
    HBond acceptors2
    Atoms60
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR54285.