canSAR1932213
FEATURES
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NAMES
    SMILES
    C#CN(Cc1ccc2nc(N)[nH]c(=O)c2c1)c1ccc(C(=O)NC(CCC(=O)NC(CCC(=O)NC(CCC(=O)[O-])C(=O)O)C(=O)O)C(=O)O)cc1
    InChI
    InChI=1S/C33H35N7O12/c1-2-40(16-17-3-8-21-20(15-17)29(46)39-33(34)38-21)19-6-4-18(5-7-19)28(45)37-24(32(51)52)10-13-26(42)35-22(30(47)48)9-12-25(41)36-23(31(49)50)11-14-27(43)44/h1,3-8,15,22-24H,9-14,16H2,(H,35,42)(H,36,41)(H,37,45)(H,43,44)(H,47,48)(H,49,50)(H,51,52)(H3,34,38,39,46)/p-1
    MOLECULAR FORMULA
    C33H34N7O12-
    CROSS REFERENCES
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    canSAR1932213
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight720.23
    AlogP-1.49
    HBond donors9
    HBond acceptors19
    Atoms86
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1932213.