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canSAR847515
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NAMES
    SMILES
    Nc1cc(N2CCN3C[C@@H](CO)CC[C@H]3C2)nc2nc(-c3ccco3)nn12
    InChI
    InChI=1S/C18H23N7O2/c19-15-8-16(20-18-21-17(22-25(15)18)14-2-1-7-27-14)24-6-5-23-9-12(11-26)3-4-13(23)10-24/h1-2,7-8,12-13,26H,3-6,9-11,19H2/t12-,13-/m0/s1
    MOLECULAR FORMULA
    C18H23N7O2
    CROSS REFERENCES
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    canSAR847515

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 369.19
    AlogP 0.86
    HBond donors 3
    HBond acceptors 9
    Atoms 50
    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 canSAR847515.