canSAR1707972
FEATURES
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NAMES
    SMILES
    O=C(CSc1ccc(-c2ccco2)nn1)N1CCCCC1
    InChI
    InChI=1S/C15H17N3O2S/c19-15(18-8-2-1-3-9-18)11-21-14-7-6-12(16-17-14)13-5-4-10-20-13/h4-7,10H,1-3,8-9,11H2
    MOLECULAR FORMULA
    C15H17N3O2S
    CROSS REFERENCES
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    canSAR1707972
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight303.10
    AlogP2.84
    HBond donors0
    HBond acceptors5
    Atoms38
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1707972.