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canSAR1965841
FEATURES
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NAMES
    SMILES
    C[C@H](NC(=O)CCCOc1ccc(Cl)cc1Cl)c1nnc2ccccn12
    InChI
    InChI=1S/C18H18Cl2N4O2/c1-12(18-23-22-16-5-2-3-9-24(16)18)21-17(25)6-4-10-26-15-8-7-13(19)11-14(15)20/h2-3,5,7-9,11-12H,4,6,10H2,1H3,(H,21,25)/t12-/m0/s1
    MOLECULAR FORMULA
    C18H18Cl2N4O2
    CROSS REFERENCES
    1965841 logo

    canSAR1965841

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 392.08
    AlogP 4.07
    HBond donors 1
    HBond acceptors 6
    Atoms 44
    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 canSAR1965841.