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canSAR835153
FEATURES
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NAMES
    SMILES
    CC(=O)N1C[C@H]2N[C@H](CC(c3ccc(CCCOc4c(F)ccc(Cl)c4F)cc3)=C2C(=O)N(Cc2cccc(Cl)c2Cl)C2CC2)C1
    InChI
    InChI=1S/C35H34Cl3F2N3O3/c1-20(44)42-18-24-16-26(22-9-7-21(8-10-22)4-3-15-46-34-29(39)14-13-28(37)33(34)40)31(30(19-42)41-24)35(45)43(25-11-12-25)17-23-5-2-6-27(36)32(23)38/h2,5-10,13-14,24-25,30,41H,3-4,11-12,15-19H2,1H3/t24-,30-/m1/s1
    MOLECULAR FORMULA
    C35H34Cl3F2N3O3
    CROSS REFERENCES
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    canSAR835153

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 687.16
    AlogP 7.47
    HBond donors 1
    HBond acceptors 6
    Atoms 80
    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 canSAR835153.