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canSAR781089
FEATURES
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NAMES
    SMILES
    CC(C)c1ccc(NC(=O)Oc2ccc3c(c2)[C@]2(C)CCN(CCc4cccnc4)[C@@H]2N3C)cc1
    InChI
    InChI=1S/C29H34N4O2/c1-20(2)22-7-9-23(10-8-22)31-28(34)35-24-11-12-26-25(18-24)29(3)14-17-33(27(29)32(26)4)16-13-21-6-5-15-30-19-21/h5-12,15,18-20,27H,13-14,16-17H2,1-4H3,(H,31,34)/t27-,29-/m0/s1
    MOLECULAR FORMULA
    C29H34N4O2
    CROSS REFERENCES
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    canSAR781089

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 470.27
    AlogP 5.80
    HBond donors 1
    HBond acceptors 6
    Atoms 69
    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 canSAR781089.