778886 logo
canSAR778886
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    Cc1cncc(Oc2ccc(NC(=O)Nc3cc(Cl)nc4ccccc34)cc2)n1
    InChI
    InChI=1S/C21H16ClN5O2/c1-13-11-23-12-20(24-13)29-15-8-6-14(7-9-15)25-21(28)27-18-10-19(22)26-17-5-3-2-4-16(17)18/h2-12H,1H3,(H2,25,26,27,28)
    MOLECULAR FORMULA
    C21H16ClN5O2
    CROSS REFERENCES
    778886 logo

    canSAR778886

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 405.10
    AlogP 5.42
    HBond donors 2
    HBond acceptors 7
    Atoms 45
    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 canSAR778886.