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canSAR831532
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NAMES
    SMILES
    Cn1c(CSc2ccccc2)nc2c(CN3CCCC3)c(O)ccc21
    InChI
    InChI=1S/C20H23N3OS/c1-22-17-9-10-18(24)16(13-23-11-5-6-12-23)20(17)21-19(22)14-25-15-7-3-2-4-8-15/h2-4,7-10,24H,5-6,11-14H2,1H3
    MOLECULAR FORMULA
    C20H23N3OS
    CROSS REFERENCES
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    canSAR831532

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 353.16
    AlogP 4.17
    HBond donors 1
    HBond acceptors 4
    Atoms 48
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR831532.