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canSAR1015085
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NAMES
    SMILES
    CCN(CC)CC#Cc1ccc2c(c1)C(=O)c1cc(C#CCN(CC)CC)ccc1-2
    InChI
    InChI=1S/C27H30N2O/c1-5-28(6-2)17-9-11-21-13-15-23-24-16-14-22(12-10-18-29(7-3)8-4)20-26(24)27(30)25(23)19-21/h13-16,19-20H,5-8,17-18H2,1-4H3
    MOLECULAR FORMULA
    C27H30N2O
    CROSS REFERENCES
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    canSAR1015085

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 398.24
    AlogP 4.28
    HBond donors 0
    HBond acceptors 3
    Atoms 60
    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 canSAR1015085.