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canSAR466089
FEATURES
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NAMES
    SMILES
    CC(C)C[C@H](NC(=O)[C@H](CCc1ccccc1)CP(=O)(O)CCCCNC(=O)OCc1ccccc1)C(=O)Nc1ccccc1
    InChI
    InChI=1S/C35H46N3O6P/c1-27(2)24-32(34(40)37-31-18-10-5-11-19-31)38-33(39)30(21-20-28-14-6-3-7-15-28)26-45(42,43)23-13-12-22-36-35(41)44-25-29-16-8-4-9-17-29/h3-11,14-19,27,30,32H,12-13,20-26H2,1-2H3,(H,36,41)(H,37,40)(H,38,39)(H,42,43)/t30-,32+/m1/s1
    MOLECULAR FORMULA
    C35H46N3O6P
    CROSS REFERENCES
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    canSAR466089

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 635.31
    AlogP 6.38
    HBond donors 4
    HBond acceptors 9
    Atoms 91
    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 canSAR466089.