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canSAR1523429
FEATURES
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NAMES
    SMILES
    COc1ccc(CCC(=O)NCCc2cn3c(C)csc3n2)cc1
    InChI
    InChI=1S/C18H21N3O2S/c1-13-12-24-18-20-15(11-21(13)18)9-10-19-17(22)8-5-14-3-6-16(23-2)7-4-14/h3-4,6-7,11-12H,5,8-10H2,1-2H3,(H,19,22)
    MOLECULAR FORMULA
    C18H21N3O2S
    CROSS REFERENCES
    1523429 logo

    canSAR1523429

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 343.14
    AlogP 3.00
    HBond donors 1
    HBond acceptors 5
    Atoms 45
    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 canSAR1523429.