1128103 logo
canSAR1128103
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    C[C@]1(CS(=O)(=O)N2CCN(c3ncc(OCc4ccc(C(F)(F)F)o4)cn3)CC2)NC(=O)NC1=O
    InChI
    InChI=1S/C19H21F3N6O6S/c1-18(15(29)25-17(30)26-18)11-35(31,32)28-6-4-27(5-7-28)16-23-8-13(9-24-16)33-10-12-2-3-14(34-12)19(20,21)22/h2-3,8-9H,4-7,10-11H2,1H3,(H2,25,26,29,30)/t18-/m1/s1
    MOLECULAR FORMULA
    C19H21F3N6O6S
    CROSS REFERENCES
    1128103 logo

    canSAR1128103

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 518.12
    AlogP 0.72
    HBond donors 2
    HBond acceptors 12
    Atoms 56
    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 canSAR1128103.