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canSAR1521688
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NAMES
    SMILES
    CCC(CC)Oc1ccc2nn(CC(=O)c3cc(N4CCOCC4)c(OC)c(C(C)(C)C)c3)c(=N)n2n1
    InChI
    InChI=1S/C27H38N6O4/c1-7-19(8-2)37-24-10-9-23-29-32(26(28)33(23)30-24)17-22(34)18-15-20(27(3,4)5)25(35-6)21(16-18)31-11-13-36-14-12-31/h9-10,15-16,19,28H,7-8,11-14,17H2,1-6H3
    MOLECULAR FORMULA
    C27H38N6O4
    CROSS REFERENCES
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    canSAR1521688

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 510.30
    AlogP 3.60
    HBond donors 1
    HBond acceptors 10
    Atoms 75
    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 canSAR1521688.