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canSAR726130
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NAMES
    SMILES
    C1=C\CCCCCC[n+]2cccc(c2)CCCCCCCCCCCC[n+]2cccc(c2)CCCCCC/1
    InChI
    InChI=1S/C36H58N2/c1-2-5-9-13-17-21-29-37-31-24-28-36(34-37)26-20-16-12-8-4-6-10-14-18-22-30-38-32-23-27-35(33-38)25-19-15-11-7-3-1/h1-2,23-24,27-28,31-34H,3-22,25-26,29-30H2/q+2/b2-1-
    MOLECULAR FORMULA
    C36H58N2+2
    CROSS REFERENCES
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    canSAR726130

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 518.46
    AlogP 9.42
    HBond donors 0
    HBond acceptors 2
    Atoms 96
    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 canSAR726130.