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canSAR1109037
FEATURES
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NAMES
    SMILES
    COc1ccccc1N1CCCN(CCCCNC(=O)c2ccc(-c3ccccc3)s2)CC1
    InChI
    InChI=1S/C27H33N3O2S/c1-32-24-13-6-5-12-23(24)30-19-9-18-29(20-21-30)17-8-7-16-28-27(31)26-15-14-25(33-26)22-10-3-2-4-11-22/h2-6,10-15H,7-9,16-21H2,1H3,(H,28,31)
    MOLECULAR FORMULA
    C27H33N3O2S
    CROSS REFERENCES
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    canSAR1109037

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 463.23
    AlogP 5.15
    HBond donors 1
    HBond acceptors 5
    Atoms 66
    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 canSAR1109037.