canSAR285139
FEATURES
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NAMES
    SMILES
    CSCC[C@@H](NC(=O)[C@@H](NC(=O)[C@H](N)C(O)c1ccccc1)C(C)C)C(=O)N[C@@H](Cc1ccc(OP(=O)(O)O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)O
    InChI
    InChI=1S/C45H66N9O17PS/c1-23(2)19-30(39(60)48-22-34(56)49-29(45(66)67)15-16-35(57)58)51-42(63)32(21-33(46)55)53-41(62)31(20-25-11-13-27(14-12-25)71-72(68,69)70)52-40(61)28(17-18-73-5)50-44(65)37(24(3)4)54-43(64)36(47)38(59)26-9-7-6-8-10-26/h6-14,23-24,28-32,36-38,59H,15-22,47H2,1-5H3,(H2,46,55)(H,48,60)(H,49,56)(H,50,65)(H,51,63)(H,52,61)(H,53,62)(H,54,64)(H,57,58)(H,66,67)(H2,68,69,70)/t28-,29+,30+,31+,32+,36-,37+,38?/m1/s1
    MOLECULAR FORMULA
    C45H66N9O17PS
    CROSS REFERENCES
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    canSAR285139
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight1067.40
    AlogP-1.93
    HBond donors16
    HBond acceptors26
    Atoms139
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR285139.