canSAR283915
FEATURES
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NAMES
    SMILES
    CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@H]1C(=O)NNC(=O)C(F)(F)F
    InChI
    InChI=1S/C55H72F3N17O13/c1-28(2)19-37(47(82)68-36(9-5-17-62-54(59)60)52(87)75-18-6-10-42(75)51(86)73-74-53(88)55(56,57)58)67-44(79)25-64-45(80)38(20-29-11-13-32(77)14-12-29)69-50(85)41(26-76)72-48(83)39(21-30-23-63-34-8-4-3-7-33(30)34)70-49(84)40(22-31-24-61-27-65-31)71-46(81)35-15-16-43(78)66-35/h3-4,7-8,11-14,23-24,27-28,35-42,63,76-77H,5-6,9-10,15-22,25-26H2,1-2H3,(H,61,65)(H,64,80)(H,66,78)(H,67,79)(H,68,82)(H,69,85)(H,70,84)(H,71,81)(H,72,83)(H,73,86)(H,74,88)(H4,59,60,62)/t35-,36-,37-,38-,39-,40-,41-,42-/m0/s1
    MOLECULAR FORMULA
    C55H72F3N17O13
    CROSS REFERENCES
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    canSAR283915
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight1235.54
    AlogP-3.28
    HBond donors18
    HBond acceptors30
    Atoms160
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR283915.