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canSAR913686
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NAMES
    SMILES
    Nc1nn2cccnc2c1-c1cc(N[C@H]2CCc3ccccc32)ncn1
    InChI
    InChI=1S/C19H17N7/c20-18-17(19-21-8-3-9-26(19)25-18)15-10-16(23-11-22-15)24-14-7-6-12-4-1-2-5-13(12)14/h1-5,8-11,14H,6-7H2,(H2,20,25)(H,22,23,24)/t14-/m0/s1
    MOLECULAR FORMULA
    C19H17N7
    CROSS REFERENCES
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    canSAR913686

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 343.15
    AlogP 2.87
    HBond donors 3
    HBond acceptors 7
    Atoms 43
    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 canSAR913686.