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canSAR1265727
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NAMES
    SMILES
    O=C(Cc1ccccn1)N1CCc2nc(-c3cnccn3)nc(O)c2C1
    InChI
    InChI=1S/C18H16N6O2/c25-16(9-12-3-1-2-5-20-12)24-8-4-14-13(11-24)18(26)23-17(22-14)15-10-19-6-7-21-15/h1-3,5-7,10H,4,8-9,11H2,(H,22,23,26)
    MOLECULAR FORMULA
    C18H16N6O2
    CROSS REFERENCES
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    canSAR1265727

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 348.13
    AlogP 1.16
    HBond donors 1
    HBond acceptors 8
    Atoms 42
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1265727.