canSAR1746806
FEATURES
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NAMES
    SMILES
    Cn1c(Nc2c(Cl)ccc(CNC(=O)C(C)(C)C)c2Cl)nc2cc(C(=O)N[C@H]3CC[C@H](C(F)(F)F)CC3)c(N3CC4CCC(C3)O4)cc21
    InChI
    InChI=1S/C34H41Cl2F3N6O3/c1-33(2,3)31(47)40-15-18-5-12-24(35)29(28(18)36)43-32-42-25-13-23(30(46)41-20-8-6-19(7-9-20)34(37,38)39)26(14-27(25)44(32)4)45-16-21-10-11-22(17-45)48-21/h5,12-14,19-22H,6-11,15-17H2,1-4H3,(H,40,47)(H,41,46)(H,42,43)/t19-,20-,21?,22?
    MOLECULAR FORMULA
    C34H41Cl2F3N6O3
    CROSS REFERENCES
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    canSAR1746806
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight708.26
    AlogP7.50
    HBond donors3
    HBond acceptors9
    Atoms89
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1746806.