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canSAR1688334
FEATURES
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NAMES
    SMILES
    C[C@@H](N)C(=O)NC1CCN(c2cc3c(cc2F)c(=O)c(C(=O)O)cn3C2CC2)C1.Cl.O
    InChI
    InChI=1S/C20H23FN4O4.ClH.H2O/c1-10(22)19(27)23-11-4-5-24(8-11)17-7-16-13(6-15(17)21)18(26)14(20(28)29)9-25(16)12-2-3-12;;/h6-7,9-12H,2-5,8,22H2,1H3,(H,23,27)(H,28,29);1H;1H2/t10-,11?;;/m1../s1
    MOLECULAR FORMULA
    C20H26ClFN4O5
    CROSS REFERENCES
    1688334 logo

    canSAR1688334

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 456.16
    AlogP 0.81
    HBond donors 6
    HBond acceptors 9
    Atoms 57
    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 canSAR1688334.