canSAR1417104
FEATURES
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NAMES
    SMILES
    O=C(CSc1nnnn1-c1ccccc1Cl)Nc1ccc2c(c1)OCCO2
    InChI
    InChI=1S/C17H14ClN5O3S/c18-12-3-1-2-4-13(12)23-17(20-21-22-23)27-10-16(24)19-11-5-6-14-15(9-11)26-8-7-25-14/h1-6,9H,7-8,10H2,(H,19,24)
    MOLECULAR FORMULA
    C17H14ClN5O3S
    CROSS REFERENCES
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    canSAR1417104
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight403.05
    AlogP2.82
    HBond donors1
    HBond acceptors8
    Atoms41
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1417104.