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canSAR1443375
FEATURES
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NAMES
    SMILES
    C=CCN1C(=O)C(=CNc2ccc(Cc3ccncc3)cc2)C(=O)NC1=S
    InChI
    InChI=1S/C20H18N4O2S/c1-2-11-24-19(26)17(18(25)23-20(24)27)13-22-16-5-3-14(4-6-16)12-15-7-9-21-10-8-15/h2-10,13,22H,1,11-12H2,(H,23,25,27)
    MOLECULAR FORMULA
    C20H18N4O2S
    CROSS REFERENCES
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    canSAR1443375

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 378.12
    AlogP 2.40
    HBond donors 2
    HBond acceptors 6
    Atoms 45
    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 canSAR1443375.