canSAR859593
FEATURES
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NAMES
    SMILES
    C[N+]12CCc3ccccc3C1c1ccc(OCCCCCCCCOc3ccc4c(c3)CC[N+]3(C)CCc5ccccc5C43)cc1CC2.[I-].[I-]
    InChI
    InChI=1S/C44H54N2O2.2HI/c1-45-25-21-33-13-7-9-15-39(33)43(45)41-19-17-37(31-35(41)23-27-45)47-29-11-5-3-4-6-12-30-48-38-18-20-42-36(32-38)24-28-46(2)26-22-34-14-8-10-16-40(34)44(42)46;;/h7-10,13-20,31-32,43-44H,3-6,11-12,21-30H2,1-2H3;2*1H/q+2;;/p-2
    MOLECULAR FORMULA
    C44H54I2N2O2
    CROSS REFERENCES
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    canSAR859593
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight896.23
    AlogP2.79
    HBond donors0
    HBond acceptors4
    Atoms104
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR859593.