77951 logo
canSAR77951
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    COCc1c(C)c(C)c(O)c(C(CCCCCC(=O)O)c2ccc(F)cc2)c1C
    InChI
    InChI=1S/C24H31FO4/c1-15-16(2)24(28)23(17(3)21(15)14-29-4)20(8-6-5-7-9-22(26)27)18-10-12-19(25)13-11-18/h10-13,20,28H,5-9,14H2,1-4H3,(H,26,27)
    MOLECULAR FORMULA
    C24H31FO4
    CROSS REFERENCES
    77951 logo

    canSAR77951

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 402.22
    AlogP 5.77
    HBond donors 2
    HBond acceptors 4
    Atoms 60
    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 canSAR77951.