canSAR824451
FEATURES
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NAMES
    SMILES
    C=CCNC(=O)C(=O)C(CCC)NC(=O)[C@@H]1[C@@H]2[C@H](CN1C(=O)[C@@H](NC(=O)N[C@H](COC(=O)NCC)C(C)(C)C)C1Cc3ccccc3C1)C2(C)C
    InChI
    InChI=1S/C38H56N6O7/c1-9-14-26(31(45)33(47)40-17-10-2)41-32(46)30-28-25(38(28,7)8)20-44(30)34(48)29(24-18-22-15-12-13-16-23(22)19-24)43-35(49)42-27(37(4,5)6)21-51-36(50)39-11-3/h10,12-13,15-16,24-30H,2,9,11,14,17-21H2,1,3-8H3,(H,39,50)(H,40,47)(H,41,46)(H2,42,43,49)/t25-,26?,27+,28-,29-,30-/m0/s1
    MOLECULAR FORMULA
    C38H56N6O7
    CROSS REFERENCES
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    canSAR824451
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight708.42
    AlogP2.87
    HBond donors5
    HBond acceptors13
    Atoms107
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR824451.