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canSAR558455
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NAMES
    SMILES
    COc1cc2nc3c(c4c2c(c1OC)N(C(C)=O)CC4)Cc1cc(OCCCN)ccc1-3
    InChI
    InChI=1S/C25H27N3O4/c1-14(29)28-9-7-18-19-12-15-11-16(32-10-4-8-26)5-6-17(15)23(19)27-20-13-21(30-2)25(31-3)24(28)22(18)20/h5-6,11,13H,4,7-10,12,26H2,1-3H3
    MOLECULAR FORMULA
    C25H27N3O4
    CROSS REFERENCES
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    canSAR558455

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 433.20
    AlogP 3.46
    HBond donors 2
    HBond acceptors 7
    Atoms 59
    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 canSAR558455.