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canSAR1021808
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NAMES
    SMILES
    CCc1cnc(N2CC[C@@H](Cn3nnc4c(N)nc(C5CC5)nc43)C2)nc1
    InChI
    InChI=1S/C18H23N9/c1-2-11-7-20-18(21-8-11)26-6-5-12(9-26)10-27-17-14(24-25-27)15(19)22-16(23-17)13-3-4-13/h7-8,12-13H,2-6,9-10H2,1H3,(H2,19,22,23)/t12-/m1/s1
    MOLECULAR FORMULA
    C18H23N9
    CROSS REFERENCES
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    canSAR1021808

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 365.21
    AlogP 1.56
    HBond donors 2
    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 canSAR1021808.