780309 logo
canSAR780309
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    Cn1cc(C(N)=O)c2c1-c1nc(NC3CCN(S(C)(=O)=O)CC3)ncc1CC2
    InChI
    InChI=1S/C18H24N6O3S/c1-23-10-14(17(19)25)13-4-3-11-9-20-18(22-15(11)16(13)23)21-12-5-7-24(8-6-12)28(2,26)27/h9-10,12H,3-8H2,1-2H3,(H2,19,25)(H,20,21,22)
    MOLECULAR FORMULA
    C18H24N6O3S
    CROSS REFERENCES
    780309 logo

    canSAR780309

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 404.16
    AlogP 0.52
    HBond donors 3
    HBond acceptors 9
    Atoms 52
    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 canSAR780309.