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canSAR1769659
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NAMES
    SMILES
    C/C=C/C=C/C=C/C[N+](C)(CCCCCCCCCCCCC)Cc1ccccc1.[I-]
    InChI
    InChI=1S/C29H48N.HI/c1-4-6-8-10-12-13-14-15-16-18-23-27-30(3,26-22-17-11-9-7-5-2)28-29-24-20-19-21-25-29;/h5,7,9,11,17,19-22,24-25H,4,6,8,10,12-16,18,23,26-28H2,1-3H3;1H/q+1;/p-1/b7-5+,11-9+,22-17+;
    MOLECULAR FORMULA
    C29H48IN
    CROSS REFERENCES
    1769659 logo

    canSAR1769659

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 537.28
    AlogP 5.64
    HBond donors 0
    HBond acceptors 1
    Atoms 79
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1769659.