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canSAR463819
FEATURES
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NAMES
    SMILES
    O=C(O)CCCCNC(=O)[C@H](c1ccc(Cl)cc1)N1C(=O)c2cc(I)ccc2NC(=O)[C@@H]1c1ccc(Cl)cc1
    InChI
    InChI=1S/C28H24Cl2IN3O5/c29-18-8-4-16(5-9-18)24(26(37)32-14-2-1-3-23(35)36)34-25(17-6-10-19(30)11-7-17)27(38)33-22-13-12-20(31)15-21(22)28(34)39/h4-13,15,24-25H,1-3,14H2,(H,32,37)(H,33,38)(H,35,36)/t24-,25-/m0/s1
    MOLECULAR FORMULA
    C28H24Cl2IN3O5
    CROSS REFERENCES
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    canSAR463819

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 679.01
    AlogP 5.85
    HBond donors 3
    HBond acceptors 8
    Atoms 63
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR463819.