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canSAR1132359
FEATURES
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NAMES
    SMILES
    CC1CCC(C(C)(C)SC2=C(SC(C)(C)C3CCC(C)CC3=O)C(=O)c3ccccc3C2=O)C(=O)C1
    InChI
    InChI=1S/C30H38O4S2/c1-17-11-13-21(23(31)15-17)29(3,4)35-27-25(33)19-9-7-8-10-20(19)26(34)28(27)36-30(5,6)22-14-12-18(2)16-24(22)32/h7-10,17-18,21-22H,11-16H2,1-6H3
    MOLECULAR FORMULA
    C30H38O4S2
    CROSS REFERENCES
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    canSAR1132359

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 526.22
    AlogP 7.31
    HBond donors 0
    HBond acceptors 4
    Atoms 74
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1132359.