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canSAR1099427
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NAMES
    SMILES
    O=C1OC2(CCN(Cc3ccccc3)CC2)c2c1csc2-c1ccc(-c2ccccc2)cc1
    InChI
    InChI=1S/C29H25NO2S/c31-28-25-20-33-27(24-13-11-23(12-14-24)22-9-5-2-6-10-22)26(25)29(32-28)15-17-30(18-16-29)19-21-7-3-1-4-8-21/h1-14,20H,15-19H2
    MOLECULAR FORMULA
    C29H25NO2S
    CROSS REFERENCES
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    canSAR1099427

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 451.16
    AlogP 6.74
    HBond donors 0
    HBond acceptors 3
    Atoms 58
    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 canSAR1099427.