1998824 logo
canSAR1998824
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    O=C(c1cccn1-c1nnc(N2CCCC2)s1)N1CCN(c2ccc(F)cc2)CC1
    InChI
    InChI=1S/C21H23FN6OS/c22-16-5-7-17(8-6-16)25-12-14-26(15-13-25)19(29)18-4-3-11-28(18)21-24-23-20(30-21)27-9-1-2-10-27/h3-8,11H,1-2,9-10,12-15H2
    MOLECULAR FORMULA
    C21H23FN6OS
    CROSS REFERENCES
    1998824 logo

    canSAR1998824

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 426.16
    AlogP 3.03
    HBond donors 0
    HBond acceptors 7
    Atoms 53
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1998824.