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canSAR1592628
FEATURES
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NAMES
    SMILES
    CCN(C[C@H]1N[C@@](Cc2ccccc2)(C(=O)OC)[C@H]2C(=O)N(Cc3ccccc3)C(=O)[C@@H]12)C(=O)Nc1ccc(C)cc1
    InChI
    InChI=1S/C33H36N4O5/c1-4-36(32(41)34-25-17-15-22(2)16-18-25)21-26-27-28(30(39)37(29(27)38)20-24-13-9-6-10-14-24)33(35-26,31(40)42-3)19-23-11-7-5-8-12-23/h5-18,26-28,35H,4,19-21H2,1-3H3,(H,34,41)/t26-,27+,28-,33-/m1/s1
    MOLECULAR FORMULA
    C33H36N4O5
    CROSS REFERENCES
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    canSAR1592628

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 568.27
    AlogP 3.78
    HBond donors 2
    HBond acceptors 9
    Atoms 78
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1592628.