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canSAR2017489
FEATURES
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NAMES
    SMILES
    CCn1c(SCC(=O)OC(C)C)nnc1-c1ccccc1
    InChI
    InChI=1S/C15H19N3O2S/c1-4-18-14(12-8-6-5-7-9-12)16-17-15(18)21-10-13(19)20-11(2)3/h5-9,11H,4,10H2,1-3H3
    MOLECULAR FORMULA
    C15H19N3O2S
    CROSS REFERENCES
    2017489 logo

    canSAR2017489

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 305.12
    AlogP 3.01
    HBond donors 0
    HBond acceptors 5
    Atoms 40
    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 canSAR2017489.