922111 logo
canSAR922111
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CNC(O)c1cccc(O)c1.CNC[C@H](O)c1cccc(O)c1
    InChI
    InChI=1S/C9H13NO2.C8H11NO2/c1-10-6-9(12)7-3-2-4-8(11)5-7;1-9-8(11)6-3-2-4-7(10)5-6/h2-5,9-12H,6H2,1H3;2-5,8-11H,1H3/t9-;/m0./s1
    MOLECULAR FORMULA
    C17H24N2O4
    CROSS REFERENCES
    922111 logo

    canSAR922111

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 320.17
    AlogP 1.25
    HBond donors 6
    HBond acceptors 6
    Atoms 47
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR922111.