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canSAR785959
FEATURES
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NAMES
    SMILES
    CCOC(=O)N1CCC[C@H]2[C@H](/C=C/c3ccc(-c4ccccc4C)cn3)[C@@H]3[C@@H](C)OC(=O)[C@@H]3C[C@@H]21
    InChI
    InChI=1S/C29H34N2O4/c1-4-34-29(33)31-15-7-10-23-24(27-19(3)35-28(32)25(27)16-26(23)31)14-13-21-12-11-20(17-30-21)22-9-6-5-8-18(22)2/h5-6,8-9,11-14,17,19,23-27H,4,7,10,15-16H2,1-3H3/b14-13+/t19-,23+,24+,25-,26+,27+/m1/s1
    MOLECULAR FORMULA
    C29H34N2O4
    CROSS REFERENCES
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    canSAR785959

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 474.25
    AlogP 5.50
    HBond donors 0
    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 canSAR785959.