745710 logo
canSAR745710
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    Nc1cccc(Nc2cc(S(=O)(=O)O)c(N)c3c2C(=O)c2ccccc2C3=O)c1
    InChI
    InChI=1S/C20H15N3O5S/c21-10-4-3-5-11(8-10)23-14-9-15(29(26,27)28)18(22)17-16(14)19(24)12-6-1-2-7-13(12)20(17)25/h1-9,23H,21-22H2,(H,26,27,28)
    MOLECULAR FORMULA
    C20H15N3O5S
    CROSS REFERENCES
    745710 logo

    canSAR745710

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 409.07
    AlogP 2.62
    HBond donors 6
    HBond acceptors 8
    Atoms 44
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR745710.