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canSAR833476
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NAMES
    SMILES
    CC(=O)c1ncn2c1COc1c(CCN3CCN(c4cccc5nc(C)ccc45)CC3)cccc1-2
    InChI
    InChI=1S/C28H29N5O2/c1-19-9-10-22-23(30-19)6-4-7-24(22)32-15-13-31(14-16-32)12-11-21-5-3-8-25-28(21)35-17-26-27(20(2)34)29-18-33(25)26/h3-10,18H,11-17H2,1-2H3
    MOLECULAR FORMULA
    C28H29N5O2
    CROSS REFERENCES
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    canSAR833476

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 467.23
    AlogP 4.19
    HBond donors 0
    HBond acceptors 7
    Atoms 64
    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 canSAR833476.