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canSAR1649309
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NAMES
    SMILES
    C=C(C)CSc1nc(N)c2c3c(sc2n1)CCC3
    InChI
    InChI=1S/C13H15N3S2/c1-7(2)6-17-13-15-11(14)10-8-4-3-5-9(8)18-12(10)16-13/h1,3-6H2,2H3,(H2,14,15,16)
    MOLECULAR FORMULA
    C13H15N3S2
    CROSS REFERENCES
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    canSAR1649309

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 277.07
    AlogP 3.43
    HBond donors 2
    HBond acceptors 3
    Atoms 33
    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 canSAR1649309.