canSAR823955
FEATURES
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NAMES
    SMILES
    N[C@@H](Cc1cc(I)c(Sc2ccc(O)c(Cc3ccc(O)nc3)c2)c(I)c1)C(=O)O
    InChI
    InChI=1S/C21H18I2N2O4S/c22-15-6-12(8-17(24)21(28)29)7-16(23)20(15)30-14-2-3-18(26)13(9-14)5-11-1-4-19(27)25-10-11/h1-4,6-7,9-10,17,26H,5,8,24H2,(H,25,27)(H,28,29)/t17-/m0/s1
    MOLECULAR FORMULA
    C21H18I2N2O4S
    CROSS REFERENCES
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    canSAR823955
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight647.91
    AlogP4.40
    HBond donors5
    HBond acceptors6
    Atoms48
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR823955.