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canSAR499386
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NAMES
    SMILES
    O=C1N(Cc2cccc(CO)c2)[C@H](CCc2ccccc2)[C@@H](CCc2ccccc2)N1Cc1cccc(CO)c1
    InChI
    InChI=1S/C35H38N2O3/c38-25-31-15-7-13-29(21-31)23-36-33(19-17-27-9-3-1-4-10-27)34(20-18-28-11-5-2-6-12-28)37(35(36)40)24-30-14-8-16-32(22-30)26-39/h1-16,21-22,33-34,38-39H,17-20,23-26H2/t33-,34-/m1/s1
    MOLECULAR FORMULA
    C35H38N2O3
    CROSS REFERENCES
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    canSAR499386

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 534.29
    AlogP 6.11
    HBond donors 2
    HBond acceptors 5
    Atoms 78
    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 canSAR499386.