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canSAR2085569
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NAMES
    SMILES
    c1ccn2nc3c(N[C@H]4C[C@@H]5CC[C@H]4C5)ncnc3c2c1
    InChI
    InChI=1S/C16H17N5/c1-2-6-21-13(3-1)14-15(20-21)16(18-9-17-14)19-12-8-10-4-5-11(12)7-10/h1-3,6,9-12H,4-5,7-8H2,(H,17,18,19)/t10-,11+,12+/m1/s1
    MOLECULAR FORMULA
    C16H17N5
    CROSS REFERENCES
    2085569 logo

    canSAR2085569

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 279.15
    AlogP 2.88
    HBond donors 1
    HBond acceptors 5
    Atoms 38
    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 canSAR2085569.