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canSAR1826710
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NAMES
    SMILES
    N#Cc1c(N/C=C2\C(=O)NC(=O)N(Cc3ccco3)C2=O)sc2c1CCCC2
    InChI
    InChI=1S/C19H16N4O4S/c20-8-13-12-5-1-2-6-15(12)28-17(13)21-9-14-16(24)22-19(26)23(18(14)25)10-11-4-3-7-27-11/h3-4,7,9,21H,1-2,5-6,10H2,(H,22,24,26)/b14-9+
    MOLECULAR FORMULA
    C19H16N4O4S
    CROSS REFERENCES
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    canSAR1826710

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 396.09
    AlogP 2.67
    HBond donors 2
    HBond acceptors 8
    Atoms 44
    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 canSAR1826710.