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canSAR1490950
FEATURES
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NAMES
    SMILES
    CC(C)(C)OC(=O)NCCCCCNC(=O)c1[nH]cnc1C(=O)Nc1cc(Br)ccc1F
    InChI
    InChI=1S/C21H27BrFN5O4/c1-21(2,3)32-20(31)25-10-6-4-5-9-24-18(29)16-17(27-12-26-16)19(30)28-15-11-13(22)7-8-14(15)23/h7-8,11-12H,4-6,9-10H2,1-3H3,(H,24,29)(H,25,31)(H,26,27)(H,28,30)
    MOLECULAR FORMULA
    C21H27BrFN5O4
    CROSS REFERENCES
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    canSAR1490950

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 511.12
    AlogP 3.99
    HBond donors 4
    HBond acceptors 9
    Atoms 59
    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 canSAR1490950.