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canSAR1638700
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NAMES
    SMILES
    O=C(Nc1ccc(Cl)c(Cl)c1)c1ccc(-n2c(O)c3c(c2O)[C@H]2C=C[C@@H]3C2)cc1
    InChI
    InChI=1S/C22H16Cl2N2O3/c23-16-8-5-14(10-17(16)24)25-20(27)11-3-6-15(7-4-11)26-21(28)18-12-1-2-13(9-12)19(18)22(26)29/h1-8,10,12-13,28-29H,9H2,(H,25,27)/t12-,13+
    MOLECULAR FORMULA
    C22H16Cl2N2O3
    CROSS REFERENCES
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    canSAR1638700

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 426.05
    AlogP 5.59
    HBond donors 3
    HBond acceptors 5
    Atoms 45
    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 canSAR1638700.