canSAR938456
FEATURES
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NAMES
    SMILES
    O=P(O)(O)Oc1ccc(-c2nc(O)c3cc([127I])ccc3n2)c(OP(=O)(O)O)c1
    InChI
    InChI=1S/C14H11IN2O9P2/c15-7-1-4-11-10(5-7)14(18)17-13(16-11)9-3-2-8(25-27(19,20)21)6-12(9)26-28(22,23)24/h1-6H,(H,16,17,18)(H2,19,20,21)(H2,22,23,24)/i15+0
    MOLECULAR FORMULA
    C14H11IN2O9P2
    CROSS REFERENCES
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    canSAR938456
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight539.90
    AlogP2.55
    HBond donors5
    HBond acceptors11
    Atoms39
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR938456.