canSAR1846421
FEATURES
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NAMES
    SMILES
    CCOc1cccc2sc(N(CCN(CC)CC)C(=O)c3cccc([N+](=O)[O-])c3)nc12
    InChI
    InChI=1S/C22H26N4O4S/c1-4-24(5-2)13-14-25(21(27)16-9-7-10-17(15-16)26(28)29)22-23-20-18(30-6-3)11-8-12-19(20)31-22/h7-12,15H,4-6,13-14H2,1-3H3
    MOLECULAR FORMULA
    C22H26N4O4S
    CROSS REFERENCES
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    canSAR1846421
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight442.17
    AlogP4.59
    HBond donors0
    HBond acceptors8
    Atoms57
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1846421.