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canSAR1499796
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NAMES
    SMILES
    O=C(COc1cccc2ccccc12)N/N=C/c1ccc(Sc2nc3ccccc3s2)o1
    InChI
    InChI=1S/C24H17N3O3S2/c28-22(15-29-20-10-5-7-16-6-1-2-8-18(16)20)27-25-14-17-12-13-23(30-17)32-24-26-19-9-3-4-11-21(19)31-24/h1-14H,15H2,(H,27,28)/b25-14+
    MOLECULAR FORMULA
    C24H17N3O3S2
    CROSS REFERENCES
    1499796 logo

    canSAR1499796

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 459.07
    AlogP 5.72
    HBond donors 1
    HBond acceptors 6
    Atoms 49
    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 canSAR1499796.