canSAR1810465
FEATURES
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NAMES
    SMILES
    COc1cc(NC(=O)C2=C(C)Nc3nnnn3C2c2ccc(SC)cc2)c(OC)cc1Cl
    InChI
    InChI=1S/C21H21ClN6O3S/c1-11-18(20(29)24-15-10-16(30-2)14(22)9-17(15)31-3)19(28-21(23-11)25-26-27-28)12-5-7-13(32-4)8-6-12/h5-10,19H,1-4H3,(H,24,29)(H,23,25,27)
    MOLECULAR FORMULA
    C21H21ClN6O3S
    CROSS REFERENCES
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    canSAR1810465
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight472.11
    AlogP3.99
    HBond donors2
    HBond acceptors9
    Atoms53
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1810465.