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canSAR1966540
FEATURES
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NAMES
    SMILES
    COc1cc2ncnc(Oc3cccc(NC(=O)Nc4cc(C(C)(C)C)on4)c3)c2cc1OCCCN1CCOCC1.Cl
    InChI
    InChI=1S/C30H36N6O6.ClH/c1-30(2,3)26-18-27(35-42-26)34-29(37)33-20-7-5-8-21(15-20)41-28-22-16-25(24(38-4)17-23(22)31-19-32-28)40-12-6-9-36-10-13-39-14-11-36;/h5,7-8,15-19H,6,9-14H2,1-4H3,(H2,33,34,35,37);1H
    MOLECULAR FORMULA
    C30H37ClN6O6
    CROSS REFERENCES
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    canSAR1966540

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 612.25
    AlogP 5.88
    HBond donors 2
    HBond acceptors 12
    Atoms 80
    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 canSAR1966540.