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canSAR466899
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NAMES
    SMILES
    O[C@H]1c2ccc(C3(C4N=NN=N4)CCCC3)cc2OC[C@@H]1C(c1ccccc1)C1CCCCC1
    InChI
    InChI=1S/C28H34N4O2/c33-26-22-14-13-21(28(15-7-8-16-28)27-29-31-32-30-27)17-24(22)34-18-23(26)25(19-9-3-1-4-10-19)20-11-5-2-6-12-20/h1,3-4,9-10,13-14,17,20,23,25-27,33H,2,5-8,11-12,15-16,18H2/t23-,25?,26+/m1/s1
    MOLECULAR FORMULA
    C28H34N4O2
    CROSS REFERENCES
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    canSAR466899

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 458.27
    AlogP 7.06
    HBond donors 1
    HBond acceptors 6
    Atoms 68
    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 canSAR466899.