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canSAR1988586
FEATURES
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NAMES
    SMILES
    CC(Nc1nccc(N2C(=O)OC[C@@H]2C(C)C)n1)c1nnc(-c2ccc(F)cc2)o1
    InChI
    InChI=1S/C20H21FN6O3/c1-11(2)15-10-29-20(28)27(15)16-8-9-22-19(24-16)23-12(3)17-25-26-18(30-17)13-4-6-14(21)7-5-13/h4-9,11-12,15H,10H2,1-3H3,(H,22,23,24)/t12?,15-/m1/s1
    MOLECULAR FORMULA
    C20H21FN6O3
    CROSS REFERENCES
    1988586 logo

    canSAR1988586

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 412.17
    AlogP 3.82
    HBond donors 1
    HBond acceptors 9
    Atoms 51
    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 canSAR1988586.