canSAR1830390
FEATURES
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NAMES
    SMILES
    CCCCNC(=O)CSc1nnc(-c2ccc(S(=O)(=O)N3CCCC3)cc2)n1C
    InChI
    InChI=1S/C19H27N5O3S2/c1-3-4-11-20-17(25)14-28-19-22-21-18(23(19)2)15-7-9-16(10-8-15)29(26,27)24-12-5-6-13-24/h7-10H,3-6,11-14H2,1-2H3,(H,20,25)
    MOLECULAR FORMULA
    C19H27N5O3S2
    CROSS REFERENCES
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    canSAR1830390
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight437.16
    AlogP2.27
    HBond donors1
    HBond acceptors8
    Atoms56
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1830390.