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canSAR347856
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NAMES
    SMILES
    NC[C@@H]1CN(c2c(-c3ccccc3)cnc3[nH]ncc23)CCO1
    InChI
    InChI=1S/C17H19N5O/c18-8-13-11-22(6-7-23-13)16-14(12-4-2-1-3-5-12)9-19-17-15(16)10-20-21-17/h1-5,9-10,13H,6-8,11,18H2,(H,19,20,21)/t13-/m1/s1
    MOLECULAR FORMULA
    C17H19N5O
    CROSS REFERENCES
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    canSAR347856

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 309.16
    AlogP 1.79
    HBond donors 3
    HBond acceptors 6
    Atoms 42
    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 canSAR347856.