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canSAR1013464
FEATURES
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NAMES
    SMILES
    C[C@@H]1CC[C@H]2[C@@H](C)[C@@H](OC(=O)CCC(=O)Oc3ccc4c(c3)C3CN(C(=O)C5CCCCC5)CC(=O)N3CC4)O[C@@H]3O[C@@]4(C)CC[C@@H]1[C@@]23OO4
    InChI
    InChI=1S/C38H50N2O10/c1-22-9-12-29-23(2)35(47-36-38(29)28(22)15-17-37(3,48-36)49-50-38)46-33(43)14-13-32(42)45-26-11-10-24-16-18-40-30(27(24)19-26)20-39(21-31(40)41)34(44)25-7-5-4-6-8-25/h10-11,19,22-23,25,28-30,35-36H,4-9,12-18,20-21H2,1-3H3/t22-,23-,28+,29+,30?,35+,36-,37-,38-/m1/s1
    MOLECULAR FORMULA
    C38H50N2O10
    CROSS REFERENCES
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    canSAR1013464

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 694.35
    AlogP 4.97
    HBond donors 0
    HBond acceptors 12
    Atoms 100
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1013464.