canSAR856192
FEATURES
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NAMES
    SMILES
    C=C1CC[C@H](OC(=O)NCC[N+](C)(C)C)C/C1=C/C=C1\CCC[C@@]2(C)[C@H]1CC[C@@H]2[C@H](C)CCCC(C)C
    InChI
    InChI=1S/C33H56N2O2/c1-24(2)11-9-12-26(4)30-18-19-31-27(13-10-20-33(30,31)5)15-16-28-23-29(17-14-25(28)3)37-32(36)34-21-22-35(6,7)8/h15-16,24,26,29-31H,3,9-14,17-23H2,1-2,4-8H3/p+1/b27-15+,28-16-/t26-,29+,30-,31+,33-/m1/s1
    MOLECULAR FORMULA
    C33H57N2O2+
    CROSS REFERENCES
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    canSAR856192
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight513.44
    AlogP8.06
    HBond donors1
    HBond acceptors4
    Atoms94
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR856192.