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canSAR55089
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NAMES
    SMILES
    O=C1OC2(CCN(C(=O)Nc3cnc(-c4ccccc4)nc3)CC2)c2ccccc21
    InChI
    InChI=1S/C23H20N4O3/c28-21-18-8-4-5-9-19(18)23(30-21)10-12-27(13-11-23)22(29)26-17-14-24-20(25-15-17)16-6-2-1-3-7-16/h1-9,14-15H,10-13H2,(H,26,29)
    MOLECULAR FORMULA
    C23H20N4O3
    CROSS REFERENCES
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    canSAR55089

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 400.15
    AlogP 3.84
    HBond donors 1
    HBond acceptors 7
    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 canSAR55089.