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canSAR1864369
FEATURES
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NAMES
    SMILES
    CCN1CC[C@H]2CNc3c(O)c4c(c(F)c3[C@H]21)C[C@H]1C[C@H]2[C@H](N(C)C)C(O)=C(C(N)=O)C(=O)[C@@]2(O)C(O)=C1C4=O
    InChI
    InChI=1S/C28H33FN4O7/c1-4-33-6-5-10-9-31-19-16(20(10)33)18(29)12-7-11-8-13-21(32(2)3)24(36)17(27(30)39)26(38)28(13,40)25(37)14(11)22(34)15(12)23(19)35/h10-11,13,20-21,31,35-37,40H,4-9H2,1-3H3,(H2,30,39)/t10-,11-,13-,20-,21-,28-/m0/s1
    MOLECULAR FORMULA
    C28H33FN4O7
    CROSS REFERENCES
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    canSAR1864369

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 556.23
    AlogP 1.07
    HBond donors 7
    HBond acceptors 11
    Atoms 73
    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 canSAR1864369.