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canSAR398850
FEATURES
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NAMES
    SMILES
    CN1CCC23c4c5ccc(O)c4OC2C(=O)C2(Cc4cc6ccccc6cc4C2)C[C@@]3(O)C1C5
    InChI
    InChI=1S/C29H27NO4/c1-30-9-8-28-23-18-6-7-21(31)24(23)34-26(28)25(32)27(15-29(28,33)22(30)12-18)13-19-10-16-4-2-3-5-17(16)11-20(19)14-27/h2-7,10-11,22,26,31,33H,8-9,12-15H2,1H3/t22?,26?,28?,29-/m1/s1
    MOLECULAR FORMULA
    C29H27NO4
    CROSS REFERENCES
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    canSAR398850

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 453.19
    AlogP 3.29
    HBond donors 2
    HBond acceptors 5
    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 canSAR398850.