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canSAR547041
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NAMES
    SMILES
    COc1cc(Cc2cnc(N)nc2N)c2c(c1OC)OC(C)(C)C=C2
    InChI
    InChI=1S/C18H22N4O3/c1-18(2)6-5-12-10(7-11-9-21-17(20)22-16(11)19)8-13(23-3)15(24-4)14(12)25-18/h5-6,8-9H,7H2,1-4H3,(H4,19,20,21,22)
    MOLECULAR FORMULA
    C18H22N4O3
    CROSS REFERENCES
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    canSAR547041

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 342.17
    AlogP 2.43
    HBond donors 4
    HBond acceptors 7
    Atoms 47
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR547041.