1594680 logo
canSAR1594680
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    O=C(O)COc1ccccc1C(Nc1cccnc1)c1cc(Cl)c2cccnc2c1O
    InChI
    InChI=1S/C23H18ClN3O4/c24-18-11-17(23(30)22-15(18)7-4-10-26-22)21(27-14-5-3-9-25-12-14)16-6-1-2-8-19(16)31-13-20(28)29/h1-12,21,27,30H,13H2,(H,28,29)
    MOLECULAR FORMULA
    C23H18ClN3O4
    CROSS REFERENCES
    1594680 logo

    canSAR1594680

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 435.10
    AlogP 4.65
    HBond donors 3
    HBond acceptors 7
    Atoms 49
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1594680.