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canSAR653941
FEATURES
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NAMES
    SMILES
    CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N[N+](=O)[O-])C(=O)NO
    InChI
    InChI=1S/C25H38N8O8/c1-25(2,3)41-24(37)32-14-8-12-19(32)22(36)29-18(15-16-9-5-4-6-10-16)20(34)28-17(21(35)31-38)11-7-13-27-23(26)30-33(39)40/h4-6,9-10,17-19,38H,7-8,11-15H2,1-3H3,(H,28,34)(H,29,36)(H,31,35)(H3,26,27,30)/t17-,18-,19-/m0/s1
    MOLECULAR FORMULA
    C25H38N8O8
    CROSS REFERENCES
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    canSAR653941

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 578.28
    AlogP 0.19
    HBond donors 7
    HBond acceptors 16
    Atoms 79
    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 canSAR653941.