2281511 logo
canSAR2281511
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CCCn1c(=O)c2[nH]c(-c3cc(OCC#Cc4cccc(F)c4)no3)nc2n(CCC)c1=O
    InChI
    InChI=1S/C23H22FN5O4/c1-3-10-28-21-19(22(30)29(11-4-2)23(28)31)25-20(26-21)17-14-18(27-33-17)32-12-6-8-15-7-5-9-16(24)13-15/h5,7,9,13-14H,3-4,10-12H2,1-2H3,(H,25,26)
    MOLECULAR FORMULA
    C23H22FN5O4
    CROSS REFERENCES
    2281511 logo

    canSAR2281511

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 451.17
    AlogP 2.93
    HBond donors 1
    HBond acceptors 9
    Atoms 55
    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 canSAR2281511.