2050614 logo
canSAR2050614
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    Fc1ccc(-c2cn(C(CN3CCNCC3)c3ccc4sc5ccccc5c4c3)nn2)c(Cl)c1
    InChI
    InChI=1S/C26H23ClFN5S/c27-22-14-18(28)6-7-20(22)23-15-33(31-30-23)24(16-32-11-9-29-10-12-32)17-5-8-26-21(13-17)19-3-1-2-4-25(19)34-26/h1-8,13-15,24,29H,9-12,16H2
    MOLECULAR FORMULA
    C26H23ClFN5S
    CROSS REFERENCES
    2050614 logo

    canSAR2050614

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 491.13
    AlogP 5.60
    HBond donors 1
    HBond acceptors 5
    Atoms 57
    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 canSAR2050614.