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canSAR993302
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NAMES
    SMILES
    O=C(Cn1cnc2sc3c(c2c1=O)CCC3)N/N=C/c1ccc(Cl)c(F)c1
    InChI
    InChI=1S/C18H14ClFN4O2S/c19-12-5-4-10(6-13(12)20)7-22-23-15(25)8-24-9-21-17-16(18(24)26)11-2-1-3-14(11)27-17/h4-7,9H,1-3,8H2,(H,23,25)/b22-7+
    MOLECULAR FORMULA
    C18H14ClFN4O2S
    CROSS REFERENCES
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    canSAR993302

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 404.05
    AlogP 2.89
    HBond donors 1
    HBond acceptors 6
    Atoms 41
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR993302.