canSAR2080540
FEATURES
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NAMES
    SMILES
    Cc1n(CC(=O)N2CCC3(C)c4ccccc4N(Cc4ccccc4)C23)cc[n+]1CC(=O)c1ccc(Br)cc1.[Br-]
    InChI
    InChI=1S/C32H32BrN4O2.BrH/c1-23-34(21-29(38)25-12-14-26(33)15-13-25)18-19-35(23)22-30(39)36-17-16-32(2)27-10-6-7-11-28(27)37(31(32)36)20-24-8-4-3-5-9-24;/h3-15,18-19,31H,16-17,20-22H2,1-2H3;1H/q+1;/p-1
    MOLECULAR FORMULA
    C32H32Br2N4O2
    CROSS REFERENCES
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    canSAR2080540
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight662.09
    AlogP2.27
    HBond donors0
    HBond acceptors6
    Atoms72
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2080540.