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canSAR1690837
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NAMES
    SMILES
    COc1ccc(-c2cccc([C@H]3[C@@H]4C=CCC[C@@]4(C)C(=O)N3Cc3ccccc3)c2)cc1
    InChI
    InChI=1S/C29H29NO2/c1-29-18-7-6-13-26(29)27(30(28(29)31)20-21-9-4-3-5-10-21)24-12-8-11-23(19-24)22-14-16-25(32-2)17-15-22/h3-6,8-17,19,26-27H,7,18,20H2,1-2H3/t26-,27-,29+/m0/s1
    MOLECULAR FORMULA
    C29H29NO2
    CROSS REFERENCES
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    canSAR1690837

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 423.22
    AlogP 6.42
    HBond donors 0
    HBond acceptors 3
    Atoms 61
    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 canSAR1690837.