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canSAR1013706
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NAMES
    SMILES
    O=C(Nc1cccnc1)c1ccc2cc3n(c2c1)CC1(CCOCC1)CNC3=O
    InChI
    InChI=1S/C22H22N4O3/c27-20(25-17-2-1-7-23-12-17)16-4-3-15-10-19-21(28)24-13-22(5-8-29-9-6-22)14-26(19)18(15)11-16/h1-4,7,10-12H,5-6,8-9,13-14H2,(H,24,28)(H,25,27)
    MOLECULAR FORMULA
    C22H22N4O3
    CROSS REFERENCES
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    canSAR1013706

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 390.17
    AlogP 2.83
    HBond donors 2
    HBond acceptors 7
    Atoms 51
    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 canSAR1013706.