651175 logo
canSAR651175
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    COc1cc(C(=O)Nc2nonc2NCc2ccc(-c3cc(Cl)cc(F)c3-c3noc(C)n3)cc2F)on1
    InChI
    InChI=1S/C23H16ClF2N7O5/c1-10-28-20(31-36-10)19-14(6-13(24)7-16(19)26)11-3-4-12(15(25)5-11)9-27-21-22(33-38-32-21)29-23(34)17-8-18(35-2)30-37-17/h3-8H,9H2,1-2H3,(H,27,32)(H,29,33,34)
    MOLECULAR FORMULA
    C23H16ClF2N7O5
    CROSS REFERENCES
    651175 logo

    canSAR651175

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 543.09
    AlogP 4.89
    HBond donors 2
    HBond acceptors 12
    Atoms 54
    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 canSAR651175.