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canSAR545750
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NAMES
    SMILES
    CN(C)c1ccc(-c2c3ccc(=[N+](C)C)cc-3sc3cc(N(C)C)ccc23)cc1
    InChI
    InChI=1S/C25H28N3S/c1-26(2)18-9-7-17(8-10-18)25-21-13-11-19(27(3)4)15-23(21)29-24-16-20(28(5)6)12-14-22(24)25/h7-16H,1-6H3/q+1
    MOLECULAR FORMULA
    C25H28N3S+
    CROSS REFERENCES
    545750 logo

    canSAR545750

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 402.20
    AlogP 4.84
    HBond donors 0
    HBond acceptors 3
    Atoms 57
    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 canSAR545750.