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canSAR1442811
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NAMES
    SMILES
    CCOC(=O)C1=C(Nc2ccc(Cl)cc2)C[C@@H](c2ccc(OC)cc2)N(c2ccc(Cl)cc2)[C@@H]1c1ccc(OC)cc1
    InChI
    InChI=1S/C34H32Cl2N2O4/c1-4-42-34(39)32-30(37-26-13-9-24(35)10-14-26)21-31(22-5-17-28(40-2)18-6-22)38(27-15-11-25(36)12-16-27)33(32)23-7-19-29(41-3)20-8-23/h5-20,31,33,37H,4,21H2,1-3H3/t31-,33+/m0/s1
    MOLECULAR FORMULA
    C34H32Cl2N2O4
    CROSS REFERENCES
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    canSAR1442811

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 602.17
    AlogP 8.63
    HBond donors 1
    HBond acceptors 6
    Atoms 74
    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 canSAR1442811.