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canSAR1067885
FEATURES
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NAMES
    SMILES
    CCC[C@H](NC(=O)[C@@H]1[C@H]2CCC[C@H]2CN1C(=O)[C@@H](N[C@@H]([C@@H](NC(=O)c1cnccn1)C1CCCCC1)C(F)(F)F)C(C)(C)C)C(=O)C(=O)NC1CC1
    InChI
    InChI=1S/C37H54F3N7O5/c1-5-10-25(29(48)34(51)43-23-15-16-23)44-33(50)28-24-14-9-13-22(24)20-47(28)35(52)31(36(2,3)4)46-30(37(38,39)40)27(21-11-7-6-8-12-21)45-32(49)26-19-41-17-18-42-26/h17-19,21-25,27-28,30-31,46H,5-16,20H2,1-4H3,(H,43,51)(H,44,50)(H,45,49)/t22-,24-,25-,27-,28-,30-,31+/m0/s1
    MOLECULAR FORMULA
    C37H54F3N7O5
    CROSS REFERENCES
    1067885 logo

    canSAR1067885

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 733.41
    AlogP 3.85
    HBond donors 4
    HBond acceptors 12
    Atoms 106
    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 canSAR1067885.