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canSAR668436
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NAMES
    SMILES
    Nc1nc(-c2ccccc2)c2c(n1)-c1cc(C(=O)N3CCNCC3)ccc1C2=O
    InChI
    InChI=1S/C22H19N5O2/c23-22-25-18(13-4-2-1-3-5-13)17-19(26-22)16-12-14(6-7-15(16)20(17)28)21(29)27-10-8-24-9-11-27/h1-7,12,24H,8-11H2,(H2,23,25,26)
    MOLECULAR FORMULA
    C22H19N5O2
    CROSS REFERENCES
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    canSAR668436

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 385.15
    AlogP 1.98
    HBond donors 3
    HBond acceptors 7
    Atoms 48
    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 canSAR668436.