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canSAR2090357
FEATURES
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NAMES
    SMILES
    Cc1noc([C@@H]2C[C@H]3OCC[C@H]3N(Cc3cc(C)c(C)o3)C2)n1.O=C(O)C(F)(F)F
    InChI
    InChI=1S/C17H23N3O3.C2HF3O2/c1-10-6-14(22-11(10)2)9-20-8-13(17-18-12(3)19-23-17)7-16-15(20)4-5-21-16;3-2(4,5)1(6)7/h6,13,15-16H,4-5,7-9H2,1-3H3;(H,6,7)/t13-,15-,16-;/m1./s1
    MOLECULAR FORMULA
    C19H24F3N3O5
    CROSS REFERENCES
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    canSAR2090357

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 431.17
    AlogP 3.37
    HBond donors 1
    HBond acceptors 8
    Atoms 54
    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 canSAR2090357.