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canSAR1635113
FEATURES
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NAMES
    SMILES
    CCCc1nn2c(=O)cc(CSCC(=O)Nc3ccccc3OC)nc2s1
    InChI
    InChI=1S/C18H20N4O3S2/c1-3-6-16-21-22-17(24)9-12(19-18(22)27-16)10-26-11-15(23)20-13-7-4-5-8-14(13)25-2/h4-5,7-9H,3,6,10-11H2,1-2H3,(H,20,23)
    MOLECULAR FORMULA
    C18H20N4O3S2
    CROSS REFERENCES
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    canSAR1635113

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 404.10
    AlogP 2.98
    HBond donors 1
    HBond acceptors 7
    Atoms 47
    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 canSAR1635113.