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canSAR840736
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NAMES
    SMILES
    CCC(=O)N1N=C(c2ccccc2)CC1c1c(C)nn(-c2ccccc2)c1Cl
    InChI
    InChI=1S/C22H21ClN4O/c1-3-20(28)27-19(14-18(25-27)16-10-6-4-7-11-16)21-15(2)24-26(22(21)23)17-12-8-5-9-13-17/h4-13,19H,3,14H2,1-2H3
    MOLECULAR FORMULA
    C22H21ClN4O
    CROSS REFERENCES
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    canSAR840736

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 392.14
    AlogP 4.92
    HBond donors 0
    HBond acceptors 5
    Atoms 49
    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 canSAR840736.