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canSAR1685442
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NAMES
    SMILES
    O=C(NCCc1ccncc1)c1ccc2nc(Cc3cccc(Cl)c3)oc2c1
    InChI
    InChI=1S/C22H18ClN3O2/c23-18-3-1-2-16(12-18)13-21-26-19-5-4-17(14-20(19)28-21)22(27)25-11-8-15-6-9-24-10-7-15/h1-7,9-10,12,14H,8,11,13H2,(H,25,27)
    MOLECULAR FORMULA
    C22H18ClN3O2
    CROSS REFERENCES
    1685442 logo

    canSAR1685442

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 391.11
    AlogP 4.44
    HBond donors 1
    HBond acceptors 5
    Atoms 46
    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 canSAR1685442.