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canSAR1020031
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NAMES
    SMILES
    CNc1ncc2c(C(C)C)nn(C[C@@H]3CCCN3)c2n1
    InChI
    InChI=1S/C14H22N6/c1-9(2)12-11-7-17-14(15-3)18-13(11)20(19-12)8-10-5-4-6-16-10/h7,9-10,16H,4-6,8H2,1-3H3,(H,15,17,18)/t10-/m0/s1
    MOLECULAR FORMULA
    C14H22N6
    CROSS REFERENCES
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    canSAR1020031

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 274.19
    AlogP 1.74
    HBond donors 2
    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 canSAR1020031.