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canSAR830867
FEATURES
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NAMES
    SMILES
    Cc1ncnc(C)c1C(=O)N1C[C@@H]2CN(CCC(c3ccccc3)C3CCN(S(=O)(=O)CC(F)(F)F)CC3)C[C@@H]2C1
    InChI
    InChI=1S/C29H38F3N5O3S/c1-20-27(21(2)34-19-33-20)28(38)36-16-24-14-35(15-25(24)17-36)11-10-26(22-6-4-3-5-7-22)23-8-12-37(13-9-23)41(39,40)18-29(30,31)32/h3-7,19,23-26H,8-18H2,1-2H3/t24-,25+,26?
    MOLECULAR FORMULA
    C29H38F3N5O3S
    CROSS REFERENCES
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    canSAR830867

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 593.26
    AlogP 3.88
    HBond donors 0
    HBond acceptors 8
    Atoms 79
    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 canSAR830867.