1617971 logo
canSAR1617971
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CCc1ncnc(-c2cc(F)c(C(=O)NC)c(F)c2)c1C#Cc1ccc(N)nc1
    InChI
    InChI=1S/C21H17F2N5O/c1-3-17-14(6-4-12-5-7-18(24)26-10-12)20(28-11-27-17)13-8-15(22)19(16(23)9-13)21(29)25-2/h5,7-11H,3H2,1-2H3,(H2,24,26)(H,25,29)
    MOLECULAR FORMULA
    C21H17F2N5O
    CROSS REFERENCES
    1617971 logo

    canSAR1617971

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 393.14
    AlogP 2.72
    HBond donors 3
    HBond acceptors 6
    Atoms 46
    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 canSAR1617971.