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canSAR1526316
FEATURES
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NAMES
    SMILES
    Cc1cccc(CSCCNC(=O)CSCc2ccc([N+](=O)[O-])cc2)c1
    InChI
    InChI=1S/C19H22N2O3S2/c1-15-3-2-4-17(11-15)13-25-10-9-20-19(22)14-26-12-16-5-7-18(8-6-16)21(23)24/h2-8,11H,9-10,12-14H2,1H3,(H,20,22)
    MOLECULAR FORMULA
    C19H22N2O3S2
    CROSS REFERENCES
    1526316 logo

    canSAR1526316

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 390.11
    AlogP 4.19
    HBond donors 1
    HBond acceptors 5
    Atoms 48
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1526316.