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canSAR468254
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NAMES
    SMILES
    O=C1NCc2c1c1c(c3c2c2ccccc2n3CCO)CCc2cc(OCCO)ccc2-1
    InChI
    InChI=1S/C26H24N2O4/c29-10-9-28-21-4-2-1-3-18(21)23-20-14-27-26(31)24(20)22-17-8-6-16(32-12-11-30)13-15(17)5-7-19(22)25(23)28/h1-4,6,8,13,29-30H,5,7,9-12,14H2,(H,27,31)
    MOLECULAR FORMULA
    C26H24N2O4
    CROSS REFERENCES
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    canSAR468254

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 428.17
    AlogP 3.17
    HBond donors 3
    HBond acceptors 6
    Atoms 56
    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 canSAR468254.