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canSAR1689492
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NAMES
    SMILES
    Cc1nn(C)c(C)c1N[S+](=O)([O-])c1ccc(-c2cccc(CN3CCCC3)c2)cc1
    InChI
    InChI=1S/C23H28N4O2S/c1-17-23(18(2)26(3)24-17)25-30(28,29)22-11-9-20(10-12-22)21-8-6-7-19(15-21)16-27-13-4-5-14-27/h6-12,15H,4-5,13-14,16H2,1-3H3,(H-,25,28,29)
    MOLECULAR FORMULA
    C23H28N4O2S
    CROSS REFERENCES
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    canSAR1689492

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 424.19
    AlogP 4.32
    HBond donors 1
    HBond acceptors 6
    Atoms 58
    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 canSAR1689492.