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canSAR1998702
FEATURES
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NAMES
    SMILES
    COc1ccccc1NC(=O)CSc1nnc(-c2ccco2)n1Cc1ccco1
    InChI
    InChI=1S/C20H18N4O4S/c1-26-16-8-3-2-7-15(16)21-18(25)13-29-20-23-22-19(17-9-5-11-28-17)24(20)12-14-6-4-10-27-14/h2-11H,12-13H2,1H3,(H,21,25)
    MOLECULAR FORMULA
    C20H18N4O4S
    CROSS REFERENCES
    1998702 logo

    canSAR1998702

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 410.10
    AlogP 3.92
    HBond donors 1
    HBond acceptors 8
    Atoms 47
    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 canSAR1998702.