1016254 logo
canSAR1016254
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    COC(=O)NCCc1ccc(Cl)c(CN(C(=O)[C@H]2CNCC(=O)N2c2ccc(CCCOc3c(F)ccc(F)c3F)cc2)C2CC2)c1
    InChI
    InChI=1S/C34H36ClF3N4O5/c1-46-34(45)40-15-14-22-6-11-26(35)23(17-22)20-41(24-9-10-24)33(44)29-18-39-19-30(43)42(29)25-7-4-21(5-8-25)3-2-16-47-32-28(37)13-12-27(36)31(32)38/h4-8,11-13,17,24,29,39H,2-3,9-10,14-16,18-20H2,1H3,(H,40,45)/t29-/m1/s1
    MOLECULAR FORMULA
    C34H36ClF3N4O5
    CROSS REFERENCES
    1016254 logo

    canSAR1016254

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 672.23
    AlogP 5.16
    HBond donors 2
    HBond acceptors 9
    Atoms 83
    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 canSAR1016254.