canSAR284479
FEATURES
Loading...
NAMES
    SMILES
    CCCCCCCCCCCCCCCCCCO[C@@]1(c2ccc(Br)cc2)SC=C(C)n2c1noc2=O
    InChI
    InChI=1S/C30H45BrN2O3S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23-35-30(26-19-21-27(31)22-20-26)28-32-36-29(34)33(28)25(2)24-37-30/h19-22,24H,3-18,23H2,1-2H3/t30-/m0/s1
    MOLECULAR FORMULA
    C30H45BrN2O3S
    CROSS REFERENCES
    Loading...
    canSAR284479
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight592.23
    AlogP9.64
    HBond donors0
    HBond acceptors5
    Atoms82
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR284479.