1724594 logo
canSAR1724594
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    COc1cccc(N2C(=O)Nc3ccc(Br)cc3C2(O)C(=O)NCCN(C)C)c1
    InChI
    InChI=1S/C20H23BrN4O4/c1-24(2)10-9-22-18(26)20(28)16-11-13(21)7-8-17(16)23-19(27)25(20)14-5-4-6-15(12-14)29-3/h4-8,11-12,28H,9-10H2,1-3H3,(H,22,26)(H,23,27)
    MOLECULAR FORMULA
    C20H23BrN4O4
    CROSS REFERENCES
    1724594 logo

    canSAR1724594

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 462.09
    AlogP 2.33
    HBond donors 3
    HBond acceptors 8
    Atoms 52
    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 canSAR1724594.