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canSAR1124071
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NAMES
    SMILES
    CCN1[C@H](c2ccccc2)CC[C@@H]1c1ccc(-c2cc(S(=O)(=O)CC)ccc2OC)[nH]1
    InChI
    InChI=1S/C25H30N2O3S/c1-4-27-23(18-9-7-6-8-10-18)14-15-24(27)22-13-12-21(26-22)20-17-19(31(28,29)5-2)11-16-25(20)30-3/h6-13,16-17,23-24,26H,4-5,14-15H2,1-3H3/t23-,24+/m0/s1
    MOLECULAR FORMULA
    C25H30N2O3S
    CROSS REFERENCES
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    canSAR1124071

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 438.20
    AlogP 5.38
    HBond donors 1
    HBond acceptors 5
    Atoms 61
    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 canSAR1124071.