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canSAR1686568
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NAMES
    SMILES
    C=CCn1c(SCc2nc3ccccc3[nH]2)nnc1-c1ccncc1
    InChI
    InChI=1S/C18H16N6S/c1-2-11-24-17(13-7-9-19-10-8-13)22-23-18(24)25-12-16-20-14-5-3-4-6-15(14)21-16/h2-10H,1,11-12H2,(H,20,21)
    MOLECULAR FORMULA
    C18H16N6S
    CROSS REFERENCES
    1686568 logo

    canSAR1686568

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 348.12
    AlogP 3.69
    HBond donors 1
    HBond acceptors 6
    Atoms 41
    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 canSAR1686568.