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canSAR34294
FEATURES
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NAMES
    SMILES
    NC(=O)C[C@@H]1NC(=O)C2(CCCCC2)NC(=O)[C@H](Cc2ccc(OP(=O)(O)O)cc2)NC(=O)CSC[C@@H](C(N)=O)NC(=O)[C@H](Cc2ccc3ccccc3c2)NC1=O
    InChI
    InChI=1S/C38H46N7O11PS/c39-31(46)19-29-35(50)42-27(18-23-8-11-24-6-2-3-7-25(24)16-23)34(49)43-30(33(40)48)20-58-21-32(47)41-28(17-22-9-12-26(13-10-22)56-57(53,54)55)36(51)45-38(37(52)44-29)14-4-1-5-15-38/h2-3,6-13,16,27-30H,1,4-5,14-15,17-21H2,(H2,39,46)(H2,40,48)(H,41,47)(H,42,50)(H,43,49)(H,44,52)(H,45,51)(H2,53,54,55)/t27-,28-,29-,30-/m0/s1
    MOLECULAR FORMULA
    C38H46N7O11PS
    CROSS REFERENCES
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    canSAR34294

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 839.27
    AlogP -0.04
    HBond donors 11
    HBond acceptors 18
    Atoms 104
    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 canSAR34294.