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canSAR501187
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NAMES
    SMILES
    O=C(O)/C(CCc1ccccc1)=N/OC(c1ccc(OCc2ccc3ccccc3n2)cc1)C1CCCCC1
    InChI
    InChI=1S/C33H34N2O4/c36-33(37)31(22-15-24-9-3-1-4-10-24)35-39-32(26-12-5-2-6-13-26)27-17-20-29(21-18-27)38-23-28-19-16-25-11-7-8-14-30(25)34-28/h1,3-4,7-11,14,16-21,26,32H,2,5-6,12-13,15,22-23H2,(H,36,37)/b35-31+
    MOLECULAR FORMULA
    C33H34N2O4
    CROSS REFERENCES
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    canSAR501187

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 522.25
    AlogP 7.53
    HBond donors 1
    HBond acceptors 6
    Atoms 73
    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 canSAR501187.