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canSAR1525353
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NAMES
    SMILES
    CCOC(=O)C(C)(C)Sc1nc(O)c2cnn(-c3ccc(C)cc3)c2n1
    InChI
    InChI=1S/C18H20N4O3S/c1-5-25-16(24)18(3,4)26-17-20-14-13(15(23)21-17)10-19-22(14)12-8-6-11(2)7-9-12/h6-10H,5H2,1-4H3,(H,20,21,23)
    MOLECULAR FORMULA
    C18H20N4O3S
    CROSS REFERENCES
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    canSAR1525353

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 372.13
    AlogP 3.26
    HBond donors 1
    HBond acceptors 7
    Atoms 46
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1525353.