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canSAR1531019
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NAMES
    SMILES
    Cc1ccsc1CN=Nc1nc2ccccc2nc1Cc1ccccc1
    InChI
    InChI=1S/C21H18N4S/c1-15-11-12-26-20(15)14-22-25-21-19(13-16-7-3-2-4-8-16)23-17-9-5-6-10-18(17)24-21/h2-12H,13-14H2,1H3
    MOLECULAR FORMULA
    C21H18N4S
    CROSS REFERENCES
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    canSAR1531019

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 358.13
    AlogP 5.87
    HBond donors 0
    HBond acceptors 4
    Atoms 44
    Contains toxicophore Yes
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1531019.