1863662 logo
canSAR1863662
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    C[C@@H](CSc1ccc(Br)cc1)CN1CC[C@H](NC(=O)OCc2ccccc2)CCC1=O
    InChI
    InChI=1S/C24H29BrN2O3S/c1-18(17-31-22-10-7-20(25)8-11-22)15-27-14-13-21(9-12-23(27)28)26-24(29)30-16-19-5-3-2-4-6-19/h2-8,10-11,18,21H,9,12-17H2,1H3,(H,26,29)/t18-,21-/m1/s1
    MOLECULAR FORMULA
    C24H29BrN2O3S
    CROSS REFERENCES
    1863662 logo

    canSAR1863662

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 504.11
    AlogP 5.48
    HBond donors 1
    HBond acceptors 5
    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 canSAR1863662.