1986969 logo
canSAR1986969
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CCc1cc2c(=O)n(CCc3ccc(F)cc3)c(=O)n(Cc3ccc(-c4ccccc4-c4nc(=O)o[nH]4)cc3)c2s1
    InChI
    InChI=1S/C31H25FN4O4S/c1-2-23-17-26-28(37)35(16-15-19-9-13-22(32)14-10-19)31(39)36(29(26)41-23)18-20-7-11-21(12-8-20)24-5-3-4-6-25(24)27-33-30(38)40-34-27/h3-14,17H,2,15-16,18H2,1H3,(H,33,34,38)
    MOLECULAR FORMULA
    C31H25FN4O4S
    CROSS REFERENCES
    1986969 logo

    canSAR1986969

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 568.16
    AlogP 5.23
    HBond donors 1
    HBond acceptors 8
    Atoms 66
    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 canSAR1986969.