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canSAR1617950
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NAMES
    SMILES
    Cc1ccc(-n2c(Cc3cccn3C)nnc2SCC(=O)NC2CCCCC2)cc1
    InChI
    InChI=1S/C23H29N5OS/c1-17-10-12-19(13-11-17)28-21(15-20-9-6-14-27(20)2)25-26-23(28)30-16-22(29)24-18-7-4-3-5-8-18/h6,9-14,18H,3-5,7-8,15-16H2,1-2H3,(H,24,29)
    MOLECULAR FORMULA
    C23H29N5OS
    CROSS REFERENCES
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    canSAR1617950

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 423.21
    AlogP 4.05
    HBond donors 1
    HBond acceptors 6
    Atoms 59
    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 canSAR1617950.