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canSAR1689828
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NAMES
    SMILES
    O=C(COc1ccc2ccccc2c1)Nc1nnc(-c2ccco2)s1
    InChI
    InChI=1S/C18H13N3O3S/c22-16(19-18-21-20-17(25-18)15-6-3-9-23-15)11-24-14-8-7-12-4-1-2-5-13(12)10-14/h1-10H,11H2,(H,19,21,22)
    MOLECULAR FORMULA
    C18H13N3O3S
    CROSS REFERENCES
    1689828 logo

    canSAR1689828

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 351.07
    AlogP 3.97
    HBond donors 1
    HBond acceptors 6
    Atoms 38
    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 canSAR1689828.