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canSAR464333
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NAMES
    SMILES
    CSc1c(Cl)nc(NCc2ccc(C(C)(C)C)cc2)nc1N1CCN(C)CC1
    InChI
    InChI=1S/C21H30ClN5S/c1-21(2,3)16-8-6-15(7-9-16)14-23-20-24-18(22)17(28-5)19(25-20)27-12-10-26(4)11-13-27/h6-9H,10-14H2,1-5H3,(H,23,24,25)
    MOLECULAR FORMULA
    C21H30ClN5S
    CROSS REFERENCES
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    canSAR464333

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 419.19
    AlogP 4.51
    HBond donors 1
    HBond acceptors 5
    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 canSAR464333.