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canSAR2085697
FEATURES
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NAMES
    SMILES
    CC[N+](C)(CC)CC(=O)N1N=C(C)CC1c1ccccc1OC
    InChI
    InChI=1S/C18H28N3O2/c1-6-21(4,7-2)13-18(22)20-16(12-14(3)19-20)15-10-8-9-11-17(15)23-5/h8-11,16H,6-7,12-13H2,1-5H3/q+1
    MOLECULAR FORMULA
    C18H28N3O2+
    CROSS REFERENCES
    2085697 logo

    canSAR2085697

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 318.22
    AlogP 2.83
    HBond donors 0
    HBond acceptors 5
    Atoms 51
    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 canSAR2085697.