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canSAR1616563
FEATURES
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NAMES
    SMILES
    Nc1nonc1C(=O)NCCNC(=O)c1ccc(Cl)cc1
    InChI
    InChI=1S/C12H12ClN5O3/c13-8-3-1-7(2-4-8)11(19)15-5-6-16-12(20)9-10(14)18-21-17-9/h1-4H,5-6H2,(H2,14,18)(H,15,19)(H,16,20)
    MOLECULAR FORMULA
    C12H12ClN5O3
    CROSS REFERENCES
    1616563 logo

    canSAR1616563

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 309.06
    AlogP 0.47
    HBond donors 4
    HBond acceptors 8
    Atoms 33
    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 canSAR1616563.