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canSAR918327
FEATURES
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NAMES
    SMILES
    CC(C)C[C@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1cscn1)NC(=O)[C@@H]1[C@H](CC(C)C)[C@H]1C(=O)N1CCOCC1
    InChI
    InChI=1S/C33H54N4O6S/c1-20(2)14-24-28(29(24)33(42)37-10-12-43-13-11-37)32(41)36-26(17-23-18-44-19-34-23)31(40)35-25(16-22-8-6-5-7-9-22)30(39)27(38)15-21(3)4/h18-22,24-30,38-39H,5-17H2,1-4H3,(H,35,40)(H,36,41)/t24-,25-,26-,27-,28+,29+,30+/m0/s1
    MOLECULAR FORMULA
    C33H54N4O6S
    CROSS REFERENCES
    918327 logo

    canSAR918327

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 634.38
    AlogP 3.16
    HBond donors 4
    HBond acceptors 10
    Atoms 98
    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 canSAR918327.