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canSAR1141379
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NAMES
    SMILES
    Cn1cc(-c2cc3[nH]nc(-c4cccc(S(N)(=O)=O)c4)c3cc2OC2CCCCC2)cn1
    InChI
    InChI=1S/C23H25N5O3S/c1-28-14-16(13-25-28)19-11-21-20(12-22(19)31-17-7-3-2-4-8-17)23(27-26-21)15-6-5-9-18(10-15)32(24,29)30/h5-6,9-14,17H,2-4,7-8H2,1H3,(H,26,27)(H2,24,29,30)
    MOLECULAR FORMULA
    C23H25N5O3S
    CROSS REFERENCES
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    canSAR1141379

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 451.17
    AlogP 3.99
    HBond donors 3
    HBond acceptors 8
    Atoms 57
    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 canSAR1141379.