1446584 logo
canSAR1446584
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    COc1cc(/C=N/n2cc(-c3ccccc3)nc2S)cc(OC)c1O
    InChI
    InChI=1S/C18H17N3O3S/c1-23-15-8-12(9-16(24-2)17(15)22)10-19-21-11-14(20-18(21)25)13-6-4-3-5-7-13/h3-11,22H,1-2H3,(H,20,25)/b19-10+
    MOLECULAR FORMULA
    C18H17N3O3S
    CROSS REFERENCES
    1446584 logo

    canSAR1446584

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 355.10
    AlogP 3.44
    HBond donors 1
    HBond acceptors 6
    Atoms 42
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1446584.