canSAR1087252
FEATURES
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NAMES
    SMILES
    NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccc2c(c1)COP(=O)(O)O2)NC(=O)OCC1c2ccccc2-c2ccccc21
    InChI
    InChI=1S/C29H28N3O10P/c30-27(35)23(13-26(33)34)31-28(36)24(12-16-9-10-25-17(11-16)14-41-43(38,39)42-25)32-29(37)40-15-22-20-7-3-1-5-18(20)19-6-2-4-8-21(19)22/h1-11,22-24H,12-15H2,(H2,30,35)(H,31,36)(H,32,37)(H,33,34)(H,38,39)/t23-,24-/m0/s1
    MOLECULAR FORMULA
    C29H28N3O10P
    CROSS REFERENCES
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    canSAR1087252
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight609.15
    AlogP2.59
    HBond donors6
    HBond acceptors13
    Atoms71
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1087252.