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canSAR501315
FEATURES
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NAMES
    SMILES
    C=CC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)[C@@H](O)CC(C)C
    InChI
    InChI=1S/C33H53N3O6/c1-7-14-25(30(39)35-26(20-23-15-10-8-11-16-23)29(38)28(37)19-22(2)3)34-31(40)27(21-24-17-12-9-13-18-24)36-32(41)42-33(4,5)6/h7,9,12-13,17-18,22-23,25-29,37-38H,1,8,10-11,14-16,19-21H2,2-6H3,(H,34,40)(H,35,39)(H,36,41)/t25-,26-,27-,28-,29+/m0/s1
    MOLECULAR FORMULA
    C33H53N3O6
    CROSS REFERENCES
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    canSAR501315

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 587.39
    AlogP 4.41
    HBond donors 5
    HBond acceptors 9
    Atoms 95
    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 canSAR501315.