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canSAR1525579
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NAMES
    SMILES
    Cc1cc(C)c(-c2cc([C@H](C)O/N=C\[C@@H](C)[C@H](OCc3ccccc3)C(C)C)on2)c(C)c1
    InChI
    InChI=1S/C28H36N2O3/c1-18(2)28(31-17-24-11-9-8-10-12-24)22(6)16-29-32-23(7)26-15-25(30-33-26)27-20(4)13-19(3)14-21(27)5/h8-16,18,22-23,28H,17H2,1-7H3/b29-16-/t22-,23+,28-/m1/s1
    MOLECULAR FORMULA
    C28H36N2O3
    CROSS REFERENCES
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    canSAR1525579

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 448.27
    AlogP 7.21
    HBond donors 0
    HBond acceptors 5
    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 canSAR1525579.