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canSAR1524737
FEATURES
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NAMES
    SMILES
    COc1ccccc1C(=O)N/C(=C\c1ccc2c(c1)OCO2)C(=O)NCCc1nc2ccccc2[nH]1
    InChI
    InChI=1S/C27H24N4O5/c1-34-22-9-5-2-6-18(22)26(32)31-21(14-17-10-11-23-24(15-17)36-16-35-23)27(33)28-13-12-25-29-19-7-3-4-8-20(19)30-25/h2-11,14-15H,12-13,16H2,1H3,(H,28,33)(H,29,30)(H,31,32)/b21-14-
    MOLECULAR FORMULA
    C27H24N4O5
    CROSS REFERENCES
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    canSAR1524737

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 484.17
    AlogP 3.43
    HBond donors 3
    HBond acceptors 9
    Atoms 60
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1524737.