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canSAR915467
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NAMES
    SMILES
    CONC(=S)N/N=C1\C(=O)N(CN2CCN(c3ccc(OC)cc3)CC2)c2ccc(C)cc21
    InChI
    InChI=1S/C23H28N6O3S/c1-16-4-9-20-19(14-16)21(24-25-23(33)26-32-3)22(30)29(20)15-27-10-12-28(13-11-27)17-5-7-18(31-2)8-6-17/h4-9,14H,10-13,15H2,1-3H3,(H2,25,26,33)/b24-21-
    MOLECULAR FORMULA
    C23H28N6O3S
    CROSS REFERENCES
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    canSAR915467

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 468.19
    AlogP 1.86
    HBond donors 2
    HBond acceptors 9
    Atoms 61
    Contains toxicophore Yes
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR915467.