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canSAR2003680
FEATURES
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NAMES
    SMILES
    CSc1ccc(CCNC(=O)CCc2nnc3ccc(N4CCOCC4)nn23)cc1
    InChI
    InChI=1S/C21H26N6O2S/c1-30-17-4-2-16(3-5-17)10-11-22-21(28)9-8-19-24-23-18-6-7-20(25-27(18)19)26-12-14-29-15-13-26/h2-7H,8-15H2,1H3,(H,22,28)
    MOLECULAR FORMULA
    C21H26N6O2S
    CROSS REFERENCES
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    canSAR2003680

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 426.18
    AlogP 1.97
    HBond donors 1
    HBond acceptors 8
    Atoms 56
    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 canSAR2003680.