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canSAR2090238
FEATURES
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NAMES
    SMILES
    CC1=N[C@@]2(CC[C@@H]3CN(CC(C)C)C[C@@H]32)C(=O)N1CC(C)C.O=C(O)C(F)(F)F
    InChI
    InChI=1S/C18H31N3O.C2HF3O2/c1-12(2)8-20-10-15-6-7-18(16(15)11-20)17(22)21(9-13(3)4)14(5)19-18;3-2(4,5)1(6)7/h12-13,15-16H,6-11H2,1-5H3;(H,6,7)/t15-,16+,18-;/m1./s1
    MOLECULAR FORMULA
    C20H32F3N3O3
    CROSS REFERENCES
    2090238 logo

    canSAR2090238

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 419.24
    AlogP 3.27
    HBond donors 1
    HBond acceptors 6
    Atoms 61
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2090238.