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canSAR780489
FEATURES
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NAMES
    SMILES
    O=C1CC2(CCN(C(=O)OC3([C@H]4COC[C@@H](CC5CC5)N4S(=O)(=O)c4ccc(Cl)cc4)CC3)CC2)N1
    InChI
    InChI=1S/C25H32ClN3O6S/c26-18-3-5-20(6-4-18)36(32,33)29-19(13-17-1-2-17)15-34-16-21(29)25(7-8-25)35-23(31)28-11-9-24(10-12-28)14-22(30)27-24/h3-6,17,19,21H,1-2,7-16H2,(H,27,30)/t19-,21-/m1/s1
    MOLECULAR FORMULA
    C25H32ClN3O6S
    CROSS REFERENCES
    780489 logo

    canSAR780489

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 537.17
    AlogP 2.92
    HBond donors 1
    HBond acceptors 9
    Atoms 68
    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 canSAR780489.