canSAR382952
FEATURES
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NAMES
    SMILES
    CC(=O)N[C@@H](Cc1ccc(OP(=O)(O)O)cc1)C(=O)N[C@H]1CCC(=O)N2CCC[C@@H](C(=O)Nc3cccc4ccccc34)N2C1=O
    InChI
    InChI=1S/C31H34N5O9P/c1-19(37)32-26(18-20-11-13-22(14-12-20)45-46(42,43)44)29(39)34-25-15-16-28(38)35-17-5-10-27(36(35)31(25)41)30(40)33-24-9-4-7-21-6-2-3-8-23(21)24/h2-4,6-9,11-14,25-27H,5,10,15-18H2,1H3,(H,32,37)(H,33,40)(H,34,39)(H2,42,43,44)/t25-,26-,27-/m0/s1
    MOLECULAR FORMULA
    C31H34N5O9P
    CROSS REFERENCES
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    canSAR382952
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight651.21
    AlogP2.01
    HBond donors5
    HBond acceptors14
    Atoms80
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR382952.