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canSAR991385
FEATURES
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NAMES
    SMILES
    COc1c(N2CCN(C/C(C)=N/Nc3ccccc3)C(C)C2)c(F)cc2c(=O)c(C(=O)O)cn(C3CC3)c12
    InChI
    InChI=1S/C28H32FN5O4/c1-17(30-31-19-7-5-4-6-8-19)14-32-11-12-33(15-18(32)2)25-23(29)13-21-24(27(25)38-3)34(20-9-10-20)16-22(26(21)35)28(36)37/h4-8,13,16,18,20,31H,9-12,14-15H2,1-3H3,(H,36,37)/b30-17+
    MOLECULAR FORMULA
    C28H32FN5O4
    CROSS REFERENCES
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    canSAR991385

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 521.24
    AlogP 4.18
    HBond donors 2
    HBond acceptors 9
    Atoms 70
    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 canSAR991385.