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canSAR1143746
FEATURES
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NAMES
    SMILES
    N=C(N)NCCC[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCO1)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O
    InChI
    InChI=1S/C31H43N9O11/c32-31(33)34-9-3-7-19(38-28(47)22(15-41)40-29(48)23-8-4-10-51-23)26(45)36-14-24(42)37-20(12-25(43)44)27(46)39-21(30(49)50)11-16-13-35-18-6-2-1-5-17(16)18/h1-2,5-6,13,19-23,35,41H,3-4,7-12,14-15H2,(H,36,45)(H,37,42)(H,38,47)(H,39,46)(H,40,48)(H,43,44)(H,49,50)(H4,32,33,34)/t19-,20-,21-,22-,23-/m0/s1
    MOLECULAR FORMULA
    C31H43N9O11
    CROSS REFERENCES
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    canSAR1143746

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 717.31
    AlogP -3.24
    HBond donors 13
    HBond acceptors 20
    Atoms 94
    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 canSAR1143746.