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canSAR65370
FEATURES
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NAMES
    SMILES
    CCC(NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(C)CC)C(=O)O
    InChI
    InChI=1S/C25H39N5O8/c1-4-14(3)21(24(36)27-13-20(33)28-17(5-2)25(37)38)30-23(35)18(8-6-7-11-26)29-22(34)16-12-15(31)9-10-19(16)32/h9-10,12,14,17-18,21,31-32H,4-8,11,13,26H2,1-3H3,(H,27,36)(H,28,33)(H,29,34)(H,30,35)(H,37,38)/t14?,17?,18-,21-/m0/s1
    MOLECULAR FORMULA
    C25H39N5O8
    CROSS REFERENCES
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    canSAR65370

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 537.28
    AlogP -0.05
    HBond donors 9
    HBond acceptors 13
    Atoms 77
    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 canSAR65370.