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canSAR464783
FEATURES
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NAMES
    SMILES
    CCCCCCCCCCCCCCCCCCOP(=O)(O)OCCC=C(c1cc(Cl)c(O)c(C(=O)O)c1)c1cc(Cl)c(O)c(C(=O)O)c1
    InChI
    InChI=1S/C36H51Cl2O10P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-47-49(45,46)48-21-18-19-28(26-22-29(35(41)42)33(39)31(37)24-26)27-23-30(36(43)44)34(40)32(38)25-27/h19,22-25,39-40H,2-18,20-21H2,1H3,(H,41,42)(H,43,44)(H,45,46)
    MOLECULAR FORMULA
    C36H51Cl2O10P
    CROSS REFERENCES
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    canSAR464783

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 744.26
    AlogP 11.02
    HBond donors 5
    HBond acceptors 10
    Atoms 100
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR464783.