canSAR633649
FEATURES
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NAMES
    SMILES
    COc1cc(C2SC(=N)Nc3c2c(C)nn3C(=O)c2ccccc2O)ccc1O
    InChI
    InChI=1S/C20H18N4O4S/c1-10-16-17(11-7-8-14(26)15(9-11)28-2)29-20(21)22-18(16)24(23-10)19(27)12-5-3-4-6-13(12)25/h3-9,17,25-26H,1-2H3,(H2,21,22)
    MOLECULAR FORMULA
    C20H18N4O4S
    CROSS REFERENCES
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    canSAR633649
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight410.10
    AlogP3.48
    HBond donors4
    HBond acceptors8
    Atoms47
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR633649.