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canSAR2089570
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NAMES
    SMILES
    Cc1nc(NCC2CCCN(C(=O)C3CCCC3)C2)cc(-c2ccc3ncsc3c2)n1
    InChI
    InChI=1S/C24H29N5OS/c1-16-27-21(19-8-9-20-22(11-19)31-15-26-20)12-23(28-16)25-13-17-5-4-10-29(14-17)24(30)18-6-2-3-7-18/h8-9,11-12,15,17-18H,2-7,10,13-14H2,1H3,(H,25,27,28)
    MOLECULAR FORMULA
    C24H29N5OS
    CROSS REFERENCES
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    canSAR2089570

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 435.21
    AlogP 4.90
    HBond donors 1
    HBond acceptors 6
    Atoms 60
    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 canSAR2089570.