729774 logo
canSAR729774
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    Cc1ccc(Cl)cc1Nc1nc(C(F)(F)F)ccc1C(=O)N/N=C/c1ccc(N(C)C)cc1
    InChI
    InChI=1S/C23H21ClF3N5O/c1-14-4-7-16(24)12-19(14)29-21-18(10-11-20(30-21)23(25,26)27)22(33)31-28-13-15-5-8-17(9-6-15)32(2)3/h4-13H,1-3H3,(H,29,30)(H,31,33)/b28-13+
    MOLECULAR FORMULA
    C23H21ClF3N5O
    CROSS REFERENCES
    729774 logo

    canSAR729774

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 475.14
    AlogP 5.64
    HBond donors 2
    HBond acceptors 6
    Atoms 54
    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 canSAR729774.