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canSAR1443016
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NAMES
    SMILES
    O=C(Nc1cc(-c2ccccc2)ccc1O)c1ccc(CNCCNc2ccccc2)cc1
    InChI
    InChI=1S/C28H27N3O2/c32-27-16-15-24(22-7-3-1-4-8-22)19-26(27)31-28(33)23-13-11-21(12-14-23)20-29-17-18-30-25-9-5-2-6-10-25/h1-16,19,29-30,32H,17-18,20H2,(H,31,33)
    MOLECULAR FORMULA
    C28H27N3O2
    CROSS REFERENCES
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    canSAR1443016

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 437.21
    AlogP 5.51
    HBond donors 4
    HBond acceptors 5
    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 canSAR1443016.