canSAR1585306
FEATURES
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NAMES
    SMILES
    O=C(CSc1nnc(C2CC2)n1C1CC1)N1CCN(c2ccc(O)cc2)CC1
    InChI
    InChI=1S/C20H25N5O2S/c26-17-7-5-15(6-8-17)23-9-11-24(12-10-23)18(27)13-28-20-22-21-19(14-1-2-14)25(20)16-3-4-16/h5-8,14,16,26H,1-4,9-13H2
    MOLECULAR FORMULA
    C20H25N5O2S
    CROSS REFERENCES
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    canSAR1585306
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight399.17
    AlogP2.64
    HBond donors1
    HBond acceptors7
    Atoms53
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1585306.