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canSAR1528445
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NAMES
    SMILES
    COc1ccc(Cl)cc1NC(=O)c1nnn(CC(=O)Nc2ccc(C)c(C)c2)c1N
    InChI
    InChI=1S/C20H21ClN6O3/c1-11-4-6-14(8-12(11)2)23-17(28)10-27-19(22)18(25-26-27)20(29)24-15-9-13(21)5-7-16(15)30-3/h4-9H,10,22H2,1-3H3,(H,23,28)(H,24,29)
    MOLECULAR FORMULA
    C20H21ClN6O3
    CROSS REFERENCES
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    canSAR1528445

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 428.14
    AlogP 3.03
    HBond donors 4
    HBond acceptors 9
    Atoms 51
    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 canSAR1528445.