1593216 logo
canSAR1593216
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CCCNC(=O)C(Cc1ccc(C(F)(F)P(=O)(OCC)OCC)cc1)NC(=O)c1ccc(C#N)cc1
    InChI
    InChI=1S/C25H30F2N3O5P/c1-4-15-29-24(32)22(30-23(31)20-11-7-19(17-28)8-12-20)16-18-9-13-21(14-10-18)25(26,27)36(33,34-5-2)35-6-3/h7-14,22H,4-6,15-16H2,1-3H3,(H,29,32)(H,30,31)
    MOLECULAR FORMULA
    C25H30F2N3O5P
    CROSS REFERENCES
    1593216 logo

    canSAR1593216

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 521.19
    AlogP 4.74
    HBond donors 2
    HBond acceptors 8
    Atoms 66
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1593216.