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canSAR1443414
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NAMES
    SMILES
    COc1ncc(-c2ccc3ncc4c(c3n2)n(C2CCOCC2)c(=O)n4CCO)cn1
    InChI
    InChI=1S/C21H22N6O4/c1-30-20-23-10-13(11-24-20)15-2-3-16-18(25-15)19-17(12-22-16)26(6-7-28)21(29)27(19)14-4-8-31-9-5-14/h2-3,10-12,14,28H,4-9H2,1H3
    MOLECULAR FORMULA
    C21H22N6O4
    CROSS REFERENCES
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    canSAR1443414

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 422.17
    AlogP 1.56
    HBond donors 1
    HBond acceptors 10
    Atoms 53
    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 canSAR1443414.