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canSAR654437
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NAMES
    SMILES
    O=C(NCc1ccc(Cl)cc1)[C@@H]1CC[C@@H](c2ccc(Cl)cc2Cl)N(c2ccc(Cl)cc2)C1
    InChI
    InChI=1S/C25H22Cl4N2O/c26-18-4-1-16(2-5-18)14-30-25(32)17-3-12-24(22-11-8-20(28)13-23(22)29)31(15-17)21-9-6-19(27)7-10-21/h1-2,4-11,13,17,24H,3,12,14-15H2,(H,30,32)/t17-,24+/m1/s1
    MOLECULAR FORMULA
    C25H22Cl4N2O
    CROSS REFERENCES
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    canSAR654437

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 506.05
    AlogP 7.57
    HBond donors 1
    HBond acceptors 3
    Atoms 54
    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 canSAR654437.