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canSAR1444029
FEATURES
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NAMES
    SMILES
    COc1cc(/C=C2\C(=N)N3C(=NC2=O)Sc2cc(S(C)(=O)=O)ccc23)ccc1O
    InChI
    InChI=1S/C19H15N3O5S2/c1-27-15-8-10(3-6-14(15)23)7-12-17(20)22-13-5-4-11(29(2,25)26)9-16(13)28-19(22)21-18(12)24/h3-9,20,23H,1-2H3/b12-7+,20-17?
    MOLECULAR FORMULA
    C19H15N3O5S2
    CROSS REFERENCES
    1444029 logo

    canSAR1444029

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 429.05
    AlogP 2.67
    HBond donors 2
    HBond acceptors 8
    Atoms 44
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1444029.