780722 logo
canSAR780722
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CCN(C[C@@H]1CCC[C@@]2(S(=O)(=O)c3ccc(C(F)(F)F)cc3)c3c(F)ccc(F)c3OC[C@@H]12)S(C)(=O)=O
    InChI
    InChI=1S/C24H26F5NO5S2/c1-3-30(36(2,31)32)13-15-5-4-12-23(18(15)14-35-22-20(26)11-10-19(25)21(22)23)37(33,34)17-8-6-16(7-9-17)24(27,28)29/h6-11,15,18H,3-5,12-14H2,1-2H3/t15-,18-,23-/m0/s1
    MOLECULAR FORMULA
    C24H26F5NO5S2
    CROSS REFERENCES
    780722 logo

    canSAR780722

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 567.12
    AlogP 4.74
    HBond donors 0
    HBond acceptors 6
    Atoms 63
    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 canSAR780722.