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canSAR548270
FEATURES
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NAMES
    SMILES
    CC(C)[C@H](NC(=O)[C@@H](CC(=O)O)N1CC[C@H](NC(=O)Cc2ccc(C(=N)N)cc2)C1=O)C(=O)O
    InChI
    InChI=1S/C22H29N5O7/c1-11(2)18(22(33)34)26-20(31)15(10-17(29)30)27-8-7-14(21(27)32)25-16(28)9-12-3-5-13(6-4-12)19(23)24/h3-6,11,14-15,18H,7-10H2,1-2H3,(H3,23,24)(H,25,28)(H,26,31)(H,29,30)(H,33,34)/t14-,15+,18-/m0/s1
    MOLECULAR FORMULA
    C22H29N5O7
    CROSS REFERENCES
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    canSAR548270

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 475.21
    AlogP -0.70
    HBond donors 7
    HBond acceptors 12
    Atoms 63
    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 canSAR548270.