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canSAR1719182
FEATURES
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NAMES
    SMILES
    CSCC[C@H](NC(=O)CCn1c2ccccc2c2ccccc21)C(=O)O
    InChI
    InChI=1S/C20H22N2O3S/c1-26-13-11-16(20(24)25)21-19(23)10-12-22-17-8-4-2-6-14(17)15-7-3-5-9-18(15)22/h2-9,16H,10-13H2,1H3,(H,21,23)(H,24,25)/t16-/m0/s1
    MOLECULAR FORMULA
    C20H22N2O3S
    CROSS REFERENCES
    1719182 logo

    canSAR1719182

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 370.14
    AlogP 3.51
    HBond donors 2
    HBond acceptors 5
    Atoms 48
    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 canSAR1719182.