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canSAR848633
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NAMES
    SMILES
    CCC(=O)N1c2ccccc2-c2nnc(SC)nc2O[C@H]1c1ccco1
    InChI
    InChI=1S/C18H16N4O3S/c1-3-14(23)22-12-8-5-4-7-11(12)15-16(19-18(26-2)21-20-15)25-17(22)13-9-6-10-24-13/h4-10,17H,3H2,1-2H3/t17-/m0/s1
    MOLECULAR FORMULA
    C18H16N4O3S
    CROSS REFERENCES
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    canSAR848633

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 368.09
    AlogP 3.69
    HBond donors 0
    HBond acceptors 7
    Atoms 42
    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 canSAR848633.