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canSAR1142463
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NAMES
    SMILES
    O=C(CCCCc1cn(Cc2ccc(Oc3ccccc3)cc2)nn1)NO
    InChI
    InChI=1S/C20H22N4O3/c25-20(22-26)9-5-4-6-17-15-24(23-21-17)14-16-10-12-19(13-11-16)27-18-7-2-1-3-8-18/h1-3,7-8,10-13,15,26H,4-6,9,14H2,(H,22,25)
    MOLECULAR FORMULA
    C20H22N4O3
    CROSS REFERENCES
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    canSAR1142463

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 366.17
    AlogP 3.34
    HBond donors 2
    HBond acceptors 7
    Atoms 49
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1142463.