92945 logo
canSAR92945
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    OC[C@@H]1[C@@H](O)[C@@H](O)CN1Cc1ccccc1
    InChI
    InChI=1S/C12H17NO3/c14-8-10-12(16)11(15)7-13(10)6-9-4-2-1-3-5-9/h1-5,10-12,14-16H,6-8H2/t10-,11+,12-/m1/s1
    MOLECULAR FORMULA
    C12H17NO3
    CROSS REFERENCES
    92945 logo

    canSAR92945

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 223.12
    AlogP -0.42
    HBond donors 3
    HBond acceptors 4
    Atoms 33
    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 canSAR92945.