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canSAR988937
FEATURES
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NAMES
    SMILES
    COCC1CCCN1S(=O)(=O)c1ccc(-c2ccc(CCN3CCC[C@H]3C)cc2)cc1
    InChI
    InChI=1S/C25H34N2O3S/c1-20-5-3-16-26(20)18-15-21-7-9-22(10-8-21)23-11-13-25(14-12-23)31(28,29)27-17-4-6-24(27)19-30-2/h7-14,20,24H,3-6,15-19H2,1-2H3/t20-,24?/m1/s1
    MOLECULAR FORMULA
    C25H34N2O3S
    CROSS REFERENCES
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    canSAR988937

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 442.23
    AlogP 4.18
    HBond donors 0
    HBond acceptors 5
    Atoms 65
    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 canSAR988937.