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canSAR1447606
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NAMES
    SMILES
    CC1(C)c2n[nH]c(Nc3nc(Cl)nc4ccsc34)c2CN1C(=O)NC1CC1c1ccccc1
    InChI
    InChI=1S/C23H22ClN7OS/c1-23(2)18-14(11-31(23)22(32)26-16-10-13(16)12-6-4-3-5-7-12)19(30-29-18)27-20-17-15(8-9-33-17)25-21(24)28-20/h3-9,13,16H,10-11H2,1-2H3,(H,26,32)(H2,25,27,28,29,30)
    MOLECULAR FORMULA
    C23H22ClN7OS
    CROSS REFERENCES
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    canSAR1447606

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 479.13
    AlogP 5.13
    HBond donors 3
    HBond acceptors 8
    Atoms 55
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1447606.