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canSAR834558
FEATURES
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NAMES
    SMILES
    C[C@H](NC(=O)CCCNC(=O)[C@]12CCC(C)(C)C[C@H]1C1=CC[C@@H]3[C@@]4(C)C[C@@H](O)[C@H](O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2)C(=O)O
    InChI
    InChI=1S/C37H60N2O6/c1-22(30(43)44)39-28(41)10-9-19-38-31(45)37-17-15-32(2,3)20-24(37)23-11-12-27-34(6)21-25(40)29(42)33(4,5)26(34)13-14-36(27,8)35(23,7)16-18-37/h11,22,24-27,29,40,42H,9-10,12-21H2,1-8H3,(H,38,45)(H,39,41)(H,43,44)/t22-,24-,25+,26-,27+,29-,34-,35+,36+,37-/m0/s1
    MOLECULAR FORMULA
    C37H60N2O6
    CROSS REFERENCES
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    canSAR834558

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 628.45
    AlogP 5.61
    HBond donors 5
    HBond acceptors 8
    Atoms 105
    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 canSAR834558.