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canSAR1618793
FEATURES
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NAMES
    SMILES
    COc1ccc(CCNC(=O)CSc2cccc3cccnc23)cc1OC
    InChI
    InChI=1S/C21H22N2O3S/c1-25-17-9-8-15(13-18(17)26-2)10-12-22-20(24)14-27-19-7-3-5-16-6-4-11-23-21(16)19/h3-9,11,13H,10,12,14H2,1-2H3,(H,22,24)
    MOLECULAR FORMULA
    C21H22N2O3S
    CROSS REFERENCES
    1618793 logo

    canSAR1618793

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 382.14
    AlogP 3.70
    HBond donors 1
    HBond acceptors 5
    Atoms 49
    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 canSAR1618793.