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canSAR1145127
FEATURES
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NAMES
    SMILES
    NC(=O)C[C@@H]1NC(=O)CNC(=O)[C@@H](CC(N)=O)NC(=O)[C@@H](Cc2ccc(O)cc2)NC(=O)[C@@H](CO)NC(=O)CCNC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC1=O
    InChI
    InChI=1S/C32H45N11O14/c33-22(47)8-17-27(52)36-6-5-25(50)39-20(12-44)31(56)40-16(7-14-1-3-15(46)4-2-14)29(54)41-18(9-23(34)48)28(53)37-11-26(51)38-19(10-24(35)49)30(55)43-21(13-45)32(57)42-17/h1-4,16-21,44-46H,5-13H2,(H2,33,47)(H2,34,48)(H2,35,49)(H,36,52)(H,37,53)(H,38,51)(H,39,50)(H,40,56)(H,41,54)(H,42,57)(H,43,55)/t16-,17+,18-,19+,20-,21+/m1/s1
    MOLECULAR FORMULA
    C32H45N11O14
    CROSS REFERENCES
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    canSAR1145127

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 807.31
    AlogP -8.91
    HBond donors 17
    HBond acceptors 25
    Atoms 102
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1145127.