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canSAR464647
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NAMES
    SMILES
    Cc1ccc(C2=NNC3(S2)C(=O)N(c2ccccc2C)c2ccc(C)cc23)cc1
    InChI
    InChI=1S/C24H21N3OS/c1-15-8-11-18(12-9-15)22-25-26-24(29-22)19-14-16(2)10-13-21(19)27(23(24)28)20-7-5-4-6-17(20)3/h4-14,26H,1-3H3
    MOLECULAR FORMULA
    C24H21N3OS
    CROSS REFERENCES
    464647 logo

    canSAR464647

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 399.14
    AlogP 5.14
    HBond donors 1
    HBond acceptors 4
    Atoms 50
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR464647.