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canSAR2086016
FEATURES
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NAMES
    SMILES
    Cc1ccccc1C(=O)N1CC[C@@H](N(C)C)[C@@H]1Cc1cnn(C)c1.O=C(O)C(F)(F)F
    InChI
    InChI=1S/C19H26N4O.C2HF3O2/c1-14-7-5-6-8-16(14)19(24)23-10-9-17(21(2)3)18(23)11-15-12-20-22(4)13-15;3-2(4,5)1(6)7/h5-8,12-13,17-18H,9-11H2,1-4H3;(H,6,7)/t17-,18+;/m1./s1
    MOLECULAR FORMULA
    C21H27F3N4O3
    CROSS REFERENCES
    2086016 logo

    canSAR2086016

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 440.20
    AlogP 2.75
    HBond donors 1
    HBond acceptors 7
    Atoms 58
    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 canSAR2086016.