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canSAR112549
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NAMES
    SMILES
    CSc1c(Cl)nc(N2CCN(C)CC2)nc1NCc1ccccc1
    InChI
    InChI=1S/C17H22ClN5S/c1-22-8-10-23(11-9-22)17-20-15(18)14(24-2)16(21-17)19-12-13-6-4-3-5-7-13/h3-7H,8-12H2,1-2H3,(H,19,20,21)
    MOLECULAR FORMULA
    C17H22ClN5S
    CROSS REFERENCES
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    canSAR112549

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 363.13
    AlogP 3.22
    HBond donors 1
    HBond acceptors 5
    Atoms 46
    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 canSAR112549.