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canSAR1508993
FEATURES
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NAMES
    SMILES
    CS(=O)(=O)Oc1ccc(/C=C2\C(=N)N3N=C(CC(=O)N4CCOCC4)SC3=NC2=O)cc1Cl
    InChI
    InChI=1S/C19H18ClN5O6S2/c1-33(28,29)31-14-3-2-11(9-13(14)20)8-12-17(21)25-19(22-18(12)27)32-15(23-25)10-16(26)24-4-6-30-7-5-24/h2-3,8-9,21H,4-7,10H2,1H3/b12-8+,21-17?
    MOLECULAR FORMULA
    C19H18ClN5O6S2
    CROSS REFERENCES
    1508993 logo

    canSAR1508993

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 511.04
    AlogP 1.55
    HBond donors 1
    HBond acceptors 11
    Atoms 51
    Contains toxicophore Yes
    Contains PAINS Yes
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1508993.