canSAR2095622
FEATURES
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NAMES
    SMILES
    CCCCCCCC(=O)N[C@@H](CCN)C(=O)N[C@H](C(=O)N[C@@H](CCN)C(=O)N[C@H]1CCNC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](CCN)NC(=O)[C@H](CCO)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](CCN)NC1=O)[C@@H](C)O
    InChI
    InChI=1S/C55H95N15O14/c1-6-7-8-9-13-16-43(74)61-35(17-23-56)50(79)70-45(33(5)73)55(84)66-37(19-25-58)46(75)64-39-21-27-60-54(83)44(32(4)72)69-51(80)38(20-26-59)63-49(78)40(22-28-71)65-52(81)41(29-31(2)3)67-53(82)42(30-34-14-11-10-12-15-34)68-47(76)36(18-24-57)62-48(39)77/h10-12,14-15,31-33,35-42,44-45,71-73H,6-9,13,16-30,56-59H2,1-5H3,(H,60,83)(H,61,74)(H,62,77)(H,63,78)(H,64,75)(H,65,81)(H,66,84)(H,67,82)(H,68,76)(H,69,80)(H,70,79)/t32-,33-,35+,36+,37+,38+,39+,40+,41+,42-,44+,45+/m1/s1
    MOLECULAR FORMULA
    C55H95N15O14
    CROSS REFERENCES
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    canSAR2095622
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight1189.72
    AlogP-5.46
    HBond donors22
    HBond acceptors29
    Atoms179
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2095622.