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canSAR1619824
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NAMES
    SMILES
    CCCc1c(O)nc(SCCN(CCC)CCC)nc1O
    InChI
    InChI=1S/C15H27N3O2S/c1-4-7-12-13(19)16-15(17-14(12)20)21-11-10-18(8-5-2)9-6-3/h4-11H2,1-3H3,(H2,16,17,19,20)
    MOLECULAR FORMULA
    C15H27N3O2S
    CROSS REFERENCES
    1619824 logo

    canSAR1619824

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 313.18
    AlogP 3.05
    HBond donors 2
    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 canSAR1619824.