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canSAR1691197
FEATURES
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NAMES
    SMILES
    Cc1cc(SCC(=O)NC2(C#N)CCCCC2)nc2c(C)cccc12
    InChI
    InChI=1S/C20H23N3OS/c1-14-7-6-8-16-15(2)11-18(22-19(14)16)25-12-17(24)23-20(13-21)9-4-3-5-10-20/h6-8,11H,3-5,9-10,12H2,1-2H3,(H,23,24)
    MOLECULAR FORMULA
    C20H23N3OS
    CROSS REFERENCES
    1691197 logo

    canSAR1691197

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 353.16
    AlogP 4.29
    HBond donors 1
    HBond acceptors 4
    Atoms 48
    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 canSAR1691197.