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canSAR1593270
FEATURES
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NAMES
    SMILES
    CNC(=O)C[C@@H](Cc1ccc(OP(=O)(O)O)cc1)C(=O)N[C@H](CCC(=O)O)C(=O)N[C@H](CC(N)=O)C(N)=O
    InChI
    InChI=1S/C21H30N5O11P/c1-24-17(28)9-12(8-11-2-4-13(5-3-11)37-38(34,35)36)20(32)25-14(6-7-18(29)30)21(33)26-15(19(23)31)10-16(22)27/h2-5,12,14-15H,6-10H2,1H3,(H2,22,27)(H2,23,31)(H,24,28)(H,25,32)(H,26,33)(H,29,30)(H2,34,35,36)/t12-,14-,15-/m1/s1
    MOLECULAR FORMULA
    C21H30N5O11P
    CROSS REFERENCES
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    canSAR1593270

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 559.17
    AlogP -2.35
    HBond donors 10
    HBond acceptors 16
    Atoms 68
    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 canSAR1593270.